fosnetupitant • ChemWhat中文网 | 凯望化学与生物数据库

N-Desmethyl Netupitant CAS#: 290296-72-9

By great_watson-int, 7th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

N-Desmethyl Netupitant is chemically 2-(3,5-Bis(trifluoromethyl)phenyl)-N,2-dimethyl-N-(6-(piperazin-1-yl)-4-(o-tolyl)pyridin-3-yl)propanamide. N-Desmethyl Netupitant is supplied with detailed characterization data compliant with regulatory guideline. N-Desmethyl Netupitant 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 fosnetupitant. 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.

Netupitant Impurity 4 CAS#: 873443-66-4

By great_watson-int, 7th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant Impurity 4 is chemically 2,6-Dichloro-4-(o-tolyl)nicotinonitrile. Netupitant Impurity 4 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant Impurity 4 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 fosnetupitant. 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.

Netupitant Impurity 7 CAS#: N/A

By great_watson-int, 7th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant Impurity 7 is chemically (6-(4-Methylpiperazin-1-yl)-4-(o-tolyl)pyridin-3-yl)methanamine. Netupitant Impurity 7 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant Impurity 7 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 fosnetupitant. 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.

Netupitant Impurity 6 CAS#: 825638-02-6

By great_watson-int, 7th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant Impurity 6 is chemically 6-(4-Methylpiperazin-1-yl)-4-(o-tolyl)nicotinonitrile. Netupitant Impurity 6 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant Impurity 6 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 fosnetupitant. 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.

Netupitant Impurity 5 CAS#: 873443-69-7

By great_watson-int, 7th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant Impurity 5 is chemically 2-Chloro-6-(4-methylpiperazin-1-yl)-4-(o-tolyl)nicotinonitrile. Netupitant Impurity 5 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant Impurity 5 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 fosnetupitant. 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.

Netupitant Impurity 3 CAS#: N/A

By great_watson-int, 7th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant Impurity 3 is chemically 2-(3,5-Bis(trifluoromethyl)phenyl)-N-(4-(2-(methoxymethyl)phenyl)-6-(4-methylpiperazin-1-yl)pyridin-3-yl)-N,2-dimethylpropanamide. Netupitant Impurity 3 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant Impurity 3 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 fosnetupitant. 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.

Netupitant N-Oxide CAS#: 910808-11-6

By great_watson-int, 7th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant N-Oxide is chemically 4-(5-(2-(3,5-Bis(trifluoromethyl)phenyl)-N,2-dimethylpropanamido)-4-(o-tolyl)pyridin-2-yl)-1-methylpiperazine 1-oxide. Netupitant N-Oxide is supplied with detailed characterization data compliant with regulatory guideline. Netupitant N-Oxide 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 fosnetupitant. 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.

Netupitant Nitroso Impurity 1 CAS#: N/A

By great_watson-int, 6th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant Nitroso Impurity 1 is chemically N-Methyl-N-(2′-methyl-5-(4-methylpiperazin-1-yl)-[1,1′-biphenyl]-2-yl)nitrous amide . Netupitant Nitroso Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant Nitroso Impurity 1 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 fosnetupitant. 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.

Netupitant Impurity 1 CAS#: 289686-70-0

By great_watson-int, 6th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant Impurity 1 is chemically 2-(3,5-Bis(trifluoromethyl)phenyl)-2-methylpropanoic acid. Netupitant Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant Impurity 1 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 fosnetupitant. 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.

Netupitant N -Oxide d6 CAS#: 2070015-12-0

By great_watson-int, 6th July 2024

Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

Identification

Physical Data

Appearance	No data available
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available
Melting Point	No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code	382290
Storage	At room temperature and away from light
Related Chemicals

Use Pattern

Netupitant N -Oxide d6 is chemically 4-(5-(2-(3,5-Bis(trifluoromethyl)phenyl)-N-methyl-2-(methyl-d3)propanamido-3,3,3-d3)-4-(o-tolyl)pyridin-2-yl)-1-methylpiperazine 1-oxide. Netupitant N -Oxide d6 is supplied with detailed characterization data compliant with regulatory guideline. Netupitant N -Oxide d6 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 fosnetupitant. 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.

英文名	N-Desmethyl Netupitant
分子结构
CAS编号	290296-72-9
EINECS Number
MDL Number
Beilstein Registry Number
别名	2-(3,5-Bis(trifluoromethyl)phenyl)-N,2-dimethyl-N-(6-(piperazin-1-yl)-4-(o-tolyl)pyridin-3-yl)propanamide
分子式	C29H30F6N4O
分子量	564.6
InChI
InChI Key
Canonical SMILES	O=C(C(C)(C)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)N(C)C2=CN=C(N3CCNCC3)C=C2C4=C(C)C=CC=C4

英文名	Netupitant Impurity 4
分子结构
CAS编号	873443-66-4
EINECS Number
MDL Number
Beilstein Registry Number
别名	2,6-Dichloro-4-(o-tolyl)nicotinonitrile
分子式	C13H8Cl2N2
分子量	263.1
InChI
InChI Key
Canonical SMILES	N#CC1=C(C2=C(C)C=CC=C2)C=C(Cl)N=C1Cl

英文名	Netupitant Impurity 7
分子结构
CAS编号	N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名	(6-(4-Methylpiperazin-1-yl)-4-(o-tolyl)pyridin-3-yl)methanamine
分子式	C18H24N4
分子量	296.4
InChI
InChI Key
Canonical SMILES	NCC1=C(C2=CC=CC=C2C)C=C(N3CCN(C)CC3)N=C1

英文名	Netupitant Impurity 6
分子结构
CAS编号	825638-02-6
EINECS Number
MDL Number
Beilstein Registry Number
别名	6-(4-Methylpiperazin-1-yl)-4-(o-tolyl)nicotinonitrile
分子式	C18H20N4
分子量	292.4
InChI
InChI Key
Canonical SMILES	N#CC1=CN=C(N2CCN(C)CC2)C=C1C3=CC=CC=C3C

英文名	Netupitant Impurity 5
分子结构
CAS编号	873443-69-7
EINECS Number
MDL Number
Beilstein Registry Number
别名	2-Chloro-6-(4-methylpiperazin-1-yl)-4-(o-tolyl)nicotinonitrile
分子式	C18H19ClN4
分子量	326.8
InChI
InChI Key
Canonical SMILES	N#CC1=C(Cl)N=C(N2CCN(C)CC2)C=C1C3=CC=CC=C3C

英文名	Netupitant Impurity 3
分子结构
CAS编号	N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名	2-(3,5-Bis(trifluoromethyl)phenyl)-N-(4-(2-(methoxymethyl)phenyl)-6-(4-methylpiperazin-1-yl)pyridin-3-yl)-N,2-dimethylpropanamide
分子式	C31H34F6N4O2
分子量	608.6
InChI
InChI Key
Canonical SMILES	CN(CC1)CCN1C2=CC(C3=CC=CC=C3COC)=C(N(C)C(C(C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)(C)C)=O)C=N2

英文名	Netupitant N-Oxide
分子结构
CAS编号	910808-11-6
EINECS Number
MDL Number
Beilstein Registry Number
别名	4-(5-(2-(3,5-Bis(trifluoromethyl)phenyl)-N,2-dimethylpropanamido)-4-(o-tolyl)pyridin-2-yl)-1-methylpiperazine 1-oxide
分子式	C30H32F6N4O2
分子量	594.6
InChI
InChI Key
Canonical SMILES	CN(C1=CN=C(N(CC2)CC[N]2(C)=O)C=C1C(C=CC=C3)=C3C)C(C(C)(C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)C)=O

英文名	Netupitant Nitroso Impurity 1
分子结构
CAS编号	N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名	N-Methyl-N-(2′-methyl-5-(4-methylpiperazin-1-yl)-[1,1′-biphenyl]-2-yl)nitrous amide
分子式	C19H24N4O
分子量	324.4
InChI
InChI Key
Canonical SMILES	O=NN(C)C1=CC=C(N2CCN(C)CC2)C=C1C3=CC=CC=C3C

英文名	Netupitant Impurity 1
分子结构
CAS编号	289686-70-0
EINECS Number
MDL Number
Beilstein Registry Number
别名	2-(3,5-Bis(trifluoromethyl)phenyl)-2-methylpropanoic acid
分子式	C12H10F6O2
分子量	300.2
InChI
InChI Key
Canonical SMILES	CC(C)(C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)C(O)=O

英文名	Netupitant N -Oxide d6
分子结构
CAS编号	2070015-12-0
EINECS Number
MDL Number
Beilstein Registry Number
别名	4-(5-(2-(3,5-Bis(trifluoromethyl)phenyl)-N-methyl-2-(methyl-d3)propanamido-3,3,3-d3)-4-(o-tolyl)pyridin-2-yl)-1-methylpiperazine 1-oxide
分子式	C30H26D6F6N4O2
分子量	600.6
InChI
InChI Key
Canonical SMILES	CN(C1=CN=C(N(CC2)CC[N]2(C)=O)C=C1C(C=CC=C3)=C3C)C(C(C([2H])([2H])[2H])(C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)C([2H])([2H])[2H])=O