Sitagliptin N-Sulfate (sodium salt)

Sitagliptin N-sulfate is a phase II metabolite of the dipeptidyl peptidase 4 (DPP-4) inhibitor (-)-sitagliptin (Cay-13252). Sitagliptin N-sulfate is formed via sulfation and has been found in rat bile following oral administration of (-)-sitagliptin.Formal Name: (R)-(4-oxo-4-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-1-(2,4,5-trifluorophenyl)butan-2-yl)sulfamate, monosodium salt. CAS Number: 2470126-25-9. Molecular Formula: C16H14F6N5O4S . Na. Formula Weight: 509.4. Purity: >95%. Formulation: (Request formulation change), A solid. Solubility: Methanol: slightly soluble. SMILES: FC1=CC(C[C@@H](NS([O-])(=O)=O)CC(N2CC3=NN=C(C(F)(F)F)N3CC2)=O)=C(F)C=C1F.[Na+]. InChi Code: InChI=1S/C16H15F6N5O4S.Na/c17-10-6-12(19)11(18)4-8(10)3-9(25-32(29,30)31)5-14(28)26-1-2-27-13(7-26)23-24-15(27)16(20,21)22,/h4,6,9,25H,1-3,5,7H2,(H,29,30,31),/q,+1/p-1/t9-,/m1./s1. InChi Key: FYMJQXVEWOAVBS-SBSPUUFOSA-M.