Sitagliptin phosphate

Inquiry
For Research Use Only.
Category
Impurities
Cat.No.
NP3340
CAS
654671-78-0
Product Name
Sitagliptin phosphate
Structure
Structure

Product Details

Description
Sitagliptin phosphate is the phosphate salt form of Sitagliptin. Sitagliptin is a dipeptidyl peptidase-4 (DPP-4) inhibitor for treatment of diabetes mellitus type 2.
Synonyms
(2R)-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-amine phosphate salt; MK-431; ONO-5435
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
Molecular Weight
505.31
Molecular Formula
C16H15F6N5O.H3O4P
Canonical SMILES
C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)CC(CC3=CC(=C(C=C3F)F)F)N.OP(=O)(O)O
InChI
InChI=1S/C16H15F6N5O.H3O4P/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22;1-5(2,3)4/h4,6,9H,1-3,5,7,23H2;(H3,1,2,3,4)/t9-;/m1./s1
InChIKey
IQFYVLUXQXSJJN-SBSPUUFOSA-N
Melting Point
202-204°C
Purity
>98%
Solubility
Soluble in DMSO (5 mg/ml at 25°C), DMF (5 mg/ml at 25°C)
Appearance
White to Off-white Solid
Application
Hypoglycemic Agents
Storage
Store at -20°C
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