Analyte Name

GSK-J5 Hydrochloride

CAS Number

1797983-32-4

Molecular Formula

C24H28ClN5O2

Molecular Weight

453.96

Accurate Mass

453.19

SMILES

O=C(OCC)CCNC1=CC(N(CC2)CCC3=C2C=CC=C3)=NC(C4=CC=CN=C4)=N1.Cl

InChI

InChI=1S/C24H27N5O2.ClH/c1-2-31-23(30)9-13-26-21-16-22(28-24(27-21)20-8-5-12-25-17-20)29-14-10-18-6-3-4-7-19(18)11-15-29;/h3-8,12,16-17H,2,9-11,13-15H2,1H3,(H,26,27,28);1H

IUPAC

ethyl 3-((2-(pyridin-3-yl)-6-(1,2,4,5-tetrahydro-3H-benzo[d]azepin-3-yl)pyrimidin-4-yl)amino)propanoate hydrogen chloride

Alternate CAS Number

1394854-51-3 - free base

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat