1-((2S,3S)-2-(Benzyloxy)pentan-3-yl)-N-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)(phenyl-d4))hydrazinecarboxamide

Analyte Name

1-((2S,3S)-2-(Benzyloxy)pentan-3-yl)-N-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)(phenyl-d4))hydrazinecarboxamide

Molecular Formula

C29 D4 H33 N5 O3

Molecular Weight

507.66

Accurate Mass

507.315

SMILES

[2H]c1c([2H])c(N2CCN(CC2)c3ccc(O)cc3)c([2H])c([2H])c1NC(=O)N(N)[C@H](CC)[C@H](C)OCc4ccccc4

InChI

InChI=1S/C29H37N5O3/c1-3-28(22(2)37-21-23-7-5-4-6-8-23)34(30)29(36)31-24-9-11-25(12-10-24)32-17-19-33(20-18-32)26-13-15-27(35)16-14-26/h4-16,22,28,35H,3,17-21,30H2,1-2H3,(H,31,36)/t22-,28+/m0/s1/i9D,10D,11D,12D

IUPAC

1-amino-1-[(2S,3R)-2-phenylmethoxypentan-3-yl]-3-[2,3,5,6-tetradeuterio-4-[4-(4-hydroxyphenyl)piperazin-1-yl]phenyl]urea

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat