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Posaconazole 杂质 78 CAS号 2514953-93-4

基本信息

CAS(化学文摘登记)号

2514953-93-4

英文名称

Posaconazole 杂质 78

英文化学名

2-((2S,3S)-2-hydroxypentan-3-yl)-4-(4-(piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

简化分子线性输入规范(SMILES)

O=C1N(C2=CC=C(N3CCNCC3)C=C2)C=NN1[C@@H](CC)[C@@H](O)C

分子式

C17H25N5O2

分子量

331.4

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Impurity 78 is chemically 2-((2S,3S)-2-hydroxypentan-3-yl)-4-(4-(piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one. Posaconazole Impurity 78 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 78 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-impurity-78-cas-2514953-93-4/

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Posaconazole 杂质 89 CAS号 N/A

基本信息

CAS(化学文摘登记)号

N/A

英文名称

Posaconazole 杂质 89

英文化学名

N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3S)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide

简化分子线性输入规范(SMILES)

FC1=CC(F)=CC=C1[C@](C2)(CN3C=NC=N3)OC[C@H]2COC4=CC=C(C=C4)N5CCN(C6=CC=C(NC(N(N)[C@@H](CC)[C@H](O)C)=O)C=C6)CC5

分子式

C36H44F2N8O4

分子量

690.8

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Impurity 89 is chemically N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3S)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide. Posaconazole Impurity 89 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 89 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-impurity-89-cas-N/A/

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Posaconazole-D-Glucuronide CAS号 N/A

基本信息

CAS(化学文摘登记)号

N/A

英文名称

Posaconazole-D-Glucuronide

英文化学名

(2S,3S,4S,5R,6R)-6-(1-(((2R,4R)-2-(2,4-difluorophenyl)-4-((4-(4-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazin-1-yl)phenoxy)methyl)tetrahydrofuran-2-yl)methyl)-1H-1,2,4-triazol-4-ium-4-yl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate

简化分子线性输入规范(SMILES)

O=C1N(C2=CC=C(N3CCN(C4=CC=C(OC[C@H]5C[C@@](C6=C(F)C=C(F)C=C6)(CN7N=C[N+]([C@]8([H])O[C@H](C([O-])=O)[C@@H](O)[C@H](O)[C@H]8O)=C7)OC5)C=C4)CC3)C=C2)C=NN1[C@H]([C@@H](O)C)CC

分子式

C43H50F2N8O10

分子量

876.9

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole-D-Glucuronide is chemically (2S,3S,4S,5R,6R)-6-(1-(((2R,4R)-2-(2,4-difluorophenyl)-4-((4-(4-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazin-1-yl)phenoxy)methyl)tetrahydrofuran-2-yl)methyl)-1H-1,2,4-triazol-4-ium-4-yl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate. Posaconazole-D-Glucuronide is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole-D-Glucuronide can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-d-glucuronide-cas-N/A/

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Posaconazole 杂质 86 CAS号 N/A

基本信息

CAS(化学文摘登记)号

N/A

英文名称

Posaconazole 杂质 86

英文化学名

4-(4-(4-(4-(((3S,5S)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3R)-2-hydroxypentan-3-yl)-1,2,4-triazolidin-3-one

简化分子线性输入规范(SMILES)

O=C1N(C2=CC=C(N3CCN(C4=CC=C(OC[C@H]5CO[C@@](C6=CC=C(F)C=C6F)(CN7N=CN=C7)C5)C=C4)CC3)C=C2)CN([C@H](CC)[C@H](O)C)N1

分子式

C37H44F2N8O4

分子量

702.8

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Impurity 86 is chemically 4-(4-(4-(4-(((3S,5S)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2R,3R)-2-hydroxypentan-3-yl)-1,2,4-triazolidin-3-one. Posaconazole Impurity 86 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 86 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-impurity-86-cas-N/A/

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Posaconazole 1-oxido 杂质 + Posaconazole 4-oxido 杂质 CAS号 N/A

基本信息

CAS(化学文摘登记)号

N/A

英文名称

Posaconazole 1-oxido 杂质 + Posaconazole 4-oxido 杂质

英文化学名

1-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)-4-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazine 1-oxide 4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)-1-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazine 1-oxide 2,2,2-trifluoroacetate

简化分子线性输入规范(SMILES)

FC1=C(C=CC(F)=C1)[C@]2(C[C@H](COC3=CC=C(N(CC4)CC[N]4(C5=CC=C(N(C=NN6[C@@H](CC)[C@@H](O)C)C6=O)C=C5)=O)C=C3)CO2)CN7C=NC=N7.FC8=C(C=CC(F)=C8)[C@]9(C[C@H](COC%10=CC=C([N]%11(CCN(C%12=CC=C(N(C=NN%13[C@@H](CC)[C@@H](O)C)C%13=O)C=C%12)CC%11)=O)C=C%10)CO9)CN%14C=NC=N%14.O=C(O)C(F)(F)F

分子式

C37H42F2N8O5 : C2HF3O2

分子量

716.8 : 114.0

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole 1-oxido impurity + Posaconazole 4-oxido impurity is chemically 1-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)-4-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazine 1-oxide 4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)-1-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazine 1-oxide 2,2,2-trifluoroacetate. Posaconazole 1-oxido impurity + Posaconazole 4-oxido impurity is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole 1-oxido impurity + Posaconazole 4-oxido impurity can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-1-oxido-impurity-posaconazole-4-oxido-impurity-cas-N/A/

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Posaconazole 杂质 85 CAS号 N/A

基本信息

CAS(化学文摘登记)号

N/A

英文名称

Posaconazole 杂质 85

英文化学名

N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2S,3S)-2-(benzyloxy)pentan-3-yl)hydrazine-1-carboxamide

简化分子线性输入规范(SMILES)

NN([C@@H](CC)[C@@H](OCC1=CC=CC=C1)C)C(NC2=CC=C(N3CCN(C4=CC=C(OC[C@@H]5CO[C@](C6=CC=C(F)C=C6F)(CN7N=CN=C7)C5)C=C4)CC3)C=C2)=O

分子式

C43H50F2N8O4

分子量

780.9

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Impurity 85 is chemically N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2S,3S)-2-(benzyloxy)pentan-3-yl)hydrazine-1-carboxamide. Posaconazole Impurity 85 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 85 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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邮箱：chemwhat@watson-int.cn

品牌

ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-impurity-85-cas-N/A/

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Posaconazole 杂质 80 CAS号 184177-88-6

基本信息

CAS(化学文摘登记)号

184177-88-6

英文名称

Posaconazole 杂质 80

英文化学名

Tert-butyl 2-[(1S,2S)-2-(benzyloxy)-1- ethylpropyl]hydrazinecarboxylate

简化分子线性输入规范(SMILES)

C[C@H](OCC1=CC=CC=C1)[C@@H](NNC(OC(C)(C)C)=O)CC

分子式

C17H28N2O3

分子量

308.4

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Impurity 80 is chemically Tert-butyl 2-[(1S,2S)-2-(benzyloxy)-1- ethylpropyl]hydrazinecarboxylate. Posaconazole Impurity 80 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 80 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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邮箱：chemwhat@watson-int.cn

品牌

ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-impurity-80-cas-184177-88-6/

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2356140-66-2 (Oxalate salt)

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Posaconazole 杂质 83 CAS号 N/A

基本信息

CAS(化学文摘登记)号

N/A

英文名称

Posaconazole 杂质 83

英文化学名

N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2S,3R)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide

简化分子线性输入规范(SMILES)

NN([C@H](CC)[C@@H](O)C)C(NC1=CC=C(N2CCN(C3=CC=C(OC[C@@H]4CO[C@](C5=CC=C(F)C=C5F)(CN6N=CN=C6)C4)C=C3)CC2)C=C1)=O

分子式

C36H44F2N8O4

分子量

690.8

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Impurity 83 is chemically N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2S,3R)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide. Posaconazole Impurity 83 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 83 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

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Posaconazole Diastereoisomer 11 (R,S,S,S) CAS号 213381-02-3

基本信息

CAS(化学文摘登记)号

213381-02-3

英文名称

Posaconazole Diastereoisomer 11 (R,S,S,S)

英文化学名

4-(4-(4-(4-(((3S,5R)-5-((1H-1,2,4-Triazol-1-Yl)Methyl)-5-(2,4-Difluorophenyl)Tetrahydrofuran-3-Yl)Methoxy)Phenyl)Piperazin-1-Yl)Phenyl)-2-((2S,3S)-2-Hydroxypentan-3-Yl)-2,4-Dihydro-3H-1,2,4-Triazol-3-One

简化分子线性输入规范(SMILES)

O=C1N([C@@H](CC)[C@@H](O)C)N=CN1C2=CC=C(N3CCN(C4=CC=C(OC[C@H]5CO[C@](C6=CC=C(F)C=C6F)(CN7N=CN=C7)C5)C=C4)CC3)C=C2

分子式

C37H42F2N8O4

分子量

700.8

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Diastereoisomer 11 (R,S,S,S) is chemically 4-(4-(4-(4-(((3S,5R)-5-((1H-1,2,4-Triazol-1-Yl)Methyl)-5-(2,4-Difluorophenyl)Tetrahydrofuran-3-Yl)Methoxy)Phenyl)Piperazin-1-Yl)Phenyl)-2-((2S,3S)-2-Hydroxypentan-3-Yl)-2,4-Dihydro-3H-1,2,4-Triazol-3-One. Posaconazole Diastereoisomer 11 (R,S,S,S) is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Diastereoisomer 11 (R,S,S,S) can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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ChemWhat（凯望）—— 品牌介绍

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https://www.chemwhat.com/posaconazole-diastereomer-impurity-cas-213381-02-3/

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Posaconazole 杂质 91 CAS号 2243786-00-5

基本信息

CAS(化学文摘登记)号

2243786-00-5

英文名称

Posaconazole 杂质 91

英文化学名

2-((2R,3S)-2-(Benzyloxy)pentan-3-yl)-4-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

简化分子线性输入规范(SMILES)

O=C1N(C2=CC=C(N3CCN(C4=CC=C(O)C=C4)CC3)C=C2)C=NN1[C@@H](CC)[C@@H](C)OCC5=CC=CC=C5

分子式

C30H35N5O3

分子量

513.6

物理性质

外观

安全信息

危险品运输编号

非危险品

德国水污染物质分类清单(WGK Germany)

3

详细规格

测试方法

核磁；质谱，液相色谱

保存条件

常温避光保存

产品描述

Posaconazole Impurity 91 is chemically 2-((2R,3S)-2-(Benzyloxy)pentan-3-yl)-4-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one. Posaconazole Impurity 91 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 91 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Posaconazole. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

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品牌

ChemWhat（凯望）—— 品牌介绍

ChemWhat官网链接地址

https://www.chemwhat.com/posaconazole-impurity-91-cas-2243786-00-5/

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