MI-503

Analyte Name

4-methyl-1-(1H-pyrazol-4-ylmethyl)-5-((4-((6-(2,2,2-trifluoroethyl)-5H-cyclopenta(d)pyrimidin-4-yl)amino)piperidin-1-yl)methyl)indole-2-carbonitrile

CAS Number

1857417-13-0

Molecular Formula

C29 H29 F3 N8

Molecular Weight

546.589

Accurate Mass

546.247

SMILES

Cc1c(CN2CCC(CC2)Nc3ncnc4C=C(CC(F)(F)F)Cc34)ccc5c1cc(C#N)n5Cc6cn[nH]c6

InChI

InChI=1S/C29H29F3N8/c1-18-21(2-3-27-24(18)10-23(12-33)40(27)15-20-13-36-37-14-20)16-39-6-4-22(5-7-39)38-28-25-8-19(11-29(30,31)32)9-26(25)34-17-35-28/h2-3,9-10,13-14,17,22H,4-8,11,15-16H2,1H3,(H,36,37)(H,34,35,38)

IUPAC

4-methyl-1-(1H-pyrazol-4-ylmethyl)-5-[[4-[[6-(2,2,2-trifluoroethyl)-5H-cyclopenta[d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat