Products 654671-77-9

CAS 654671-77-9 appears in our catalog under these names: Sitagliptin Monophosphate Monohydrate, Sitagliptin Phosphate Monohydrate, Sitagliptin phosphate monohydrate, Sitagliptin phosphate monohydrate - Bio-X â„¢, Sitagliptin phosphate hydrate, 98.00%. Offered by: Chemat Brand, Mikromol, LoGiCal, TargetMol, GLPBio. Available pack sizes: on request, 250mg, 10mg, 100mg, 1000mg, 200mg, 2000mg, 10mM (in 1ml dmso).

Structural formula: {0} (CAS {1})

(3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;phosphoric acid;hydrate (CAS 654671-77-9) is a chemical compound with the molecular formula C16H20F6N5O6P and a molecular weight of 523.32 g/mol. IUPAC name: (3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;phosphoric acid;hydrate. InChIKey: GQPYTJVDPQTBQC-KLQYNRQASA-N.

Identity
Molecular formulaC16H20F6N5O6P
Molecular weight523.32 g/mol
IUPAC name(3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;phosphoric acid;hydrate
InChIKeyGQPYTJVDPQTBQC-KLQYNRQASA-N
SMILESC1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C[C@@H](CC3=CC(=C(C=C3F)F)F)N.O.OP(=O)(O)O

Computed by PubChem (NCBI)