Analyte Name

Gemigliptin

CAS Number

1523530-62-2

Molecular Formula

C18 H19 F8 N5 O2 . Cl H

Molecular Weight

489.363

Accurate Mass

489.141

SMILES

C(F)(F)(F)C1=C2C(CN(C(C[C@@H](CN3CC(F)(F)CCC3=O)N)=O)CC2)=NC(C(F)(F)F)=N1.Cl

InChI

InChI=1S/C18H19F8N5O2/c19-16(20)3-1-12(32)31(8-16)6-9(27)5-13(33)30-4-2-10-11(7-30)28-15(18(24,25)26)29-14(10)17(21,22)23/h9H,1-8,27H2/t9-/m0/s1

IUPAC

1-[(2S)-2-amino-4-[2,4-bis(trifluoromethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]-4-oxobutyl]-5,5-difluoropiperidin-2-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat