Aprepitant CAS NO.170729-80-3

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Name:

Aprepitant (Related Reference)

Molecular Formula:

C₂₃H₂₁F₇N₄O₃

CAS Registry Number:

170729-80-3

Synonyms:

3H-1,2,4-Triazol-3-one,5-[[2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-,[2R-[2a(R*),3a]]-; Emend; L 754030; MK 0869; MK 869; ONO7436;

InChI:

InChI=1/C23H21F7N4O3/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)37-20-19(13-2-4-17(24)5-3-13)34(6-7-36-20)11-18-31-21(35)33-32-18/h2-5,8-10,12,19-20H,6-7,11H2,1H3,(H2,31,32,33,35)/t12-,19+,20-/m1/s1

Molecular Structure:

Chemical Properties

Appearance:

Off-White to Light Yellow Cyrstalline Solid

Molecular Weight:

534.43

Density:

1.51 g/cm³

Refractive index:

1.564

Usage:

A novelive neurokinin-1 (NK-1) receptantagonist. In vitro studies using human liver microsomes indicate that Aprepitant is metabolised primarily by CYP3A4 with minmetabolism by CYP1A2 CYP2C19, no metabolism by CYP2D6, CYP2C9, CYP2

Safety Data of 170729-80-3