Aprepitant-d4 N-Oxide

• Synonyms:

  [2R-[2α(R*),3α]]-5-[[2-[1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl-d4)-4-oxido-4-morpholinyl]methyl]-1,2-dihydro-3H-1,2,4-triazol-3-one

• Hazard Statement:

  No Data Available

• Smiles:

  O=[N]([C@@H](C1=C([2H])C([2H])=C(F)C([2H])=C1[2H])[C@H]2O[C@@H](C3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)C)(CCO2)CC(N4)=NNC4=O

• Molecular Formula:

  C23H17D4F7N4O4

• Molecular Weight:

  554.45

• InChI:

  InChI=1S/C23H21F7N4O4/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)38-20-19(13-2-4-17(24)5-3-13)34(36,6-7-37-20)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+,34?/m0/s1/i2D,3D,4D,5D

• Additionnal Information:

  IUPAC name: (2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl-2,3,5,6-d4)-4-((5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)morpholine 4-oxide

• Shipping Conditions:

  Room Temperature