Analyte Name

Aurora B Inhibitor 1

CAS Number

937276-52-3

Molecular Formula

C25 H26 Cl F2 N7 O2

Molecular Weight

529.97

Accurate Mass

529.18

SMILES

Cc1cc(Nc2cc(nc(O[C@H]3CCN(C3)C(=O)c4cc(Cl)ccc4F)n2)N5CC(F)(C5)C6CC6)n[nH]1

InChI

InChI=1S/C25H26ClF2N7O2/c1-14-8-21(33-32-14)29-20-10-22(35-12-25(28,13-35)15-2-3-15)31-24(30-20)37-17-6-7-34(11-17)23(36)18-9-16(26)4-5-19(18)27/h4-5,8-10,15,17H,2-3,6-7,11-13H2,1H3,(H2,29,30,31,32,33)/t17-/m0/s1

IUPAC

(5-chloro-2-fluorophenyl)-[(3S)-3-[4-(3-cyclopropyl-3-fluoroazetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxypyrrolidin-1-yl]methanone

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat