ChemicalBook--->CAS DataBase List--->170902-81-5

170902-81-5

170902-81-5 Structure

170902-81-5 Structure
IdentificationBack Directory
[Name]

Aprepitant Impurity 6
[CAS]

170902-81-5
[Synonyms]

1S, 2R, 3S-Aripitan
Aprepitant Impurity 6
Aprepitant Impurity 5(S,R,S-Isomer)
Fosaprepitant Dimeglumine Impurity A
Arepitam impurity isomers (1S, 2R, 3S)
Fosaprepitant Dimeglumine EP Impurity A
Aprepitant impurity 9/(1S,2R,3S)-Aprepitant
[1(S)-Phenylethoxy]-Aprepitant/ Aprepitant S,R,S-Isomer
5-([(2R,3S)-2-((S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy)-3-(4-fluoro phenyl)morpholino]methyl)-1H-1,2,4-triazol-3(2H)-one
5-(((2R,3S)-2-((S)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
3H-1,2,4-Triazol-3-one, 5-[[(2R,3S)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-
[Molecular Formula]

C23H21F7N4O3
[MOL File]

170902-81-5.mol
[Molecular Weight]

534.43
Chemical PropertiesBack Directory
[density ]

1.51±0.1 g/cm3(Predicted)
[pka]

8.06±0.20(Predicted)
Hazard InformationBack Directory
[Uses]

[1(S)-Phenylethoxy]-Aprepitant is a derivative of Aprepitant (A729800), a novel selective neurokinin-1 (NK-1) receptor antagonist. In vitro studies using human liver microsomes indicate that Aprepitant is metabolised primarily by CYP3A4 with minor metabolism by CYP1A2 and CYP2C19, and no metabolism by CYP2D6, CYP2C9, or CYP2E1.
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