Sitagliptin
Also known as: (3R)-3-Amino-1-[3-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one, MK-0431, Unii-qfp0p1dv7z, (3R)-3-amino-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)butan-1-one
Sitagliptin (CAS 486460-32-6) is a compound in the Organic Compounds category listed in the Jingsj chemical database. It has the molecular formula C16H15F6N5O and a molecular weight of 407.314 g/mol. Key properties include a boiling point of 529.9±60.0 °C at 760 mmHg, a density of 1.6±0.1 g/cm3 and a flash point of 274.3±32.9 °C. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.
- CAS No.
- 486460-32-6
- Jingsj CID
- J-1985184-4
- Molecular Formula
- C16H15F6N5O
- Molecular Weight
- 407.314 g/mol
- Category
- Organic Compounds
- Last updated
- 8/21/2026
No offers for this compound yet.
Request a quotePhysicochemical Properties
| Boiling Point | 529.9±60.0 °C at 760 mmHg |
|---|---|
| Density | 1.6±0.1 g/cm3 |
| Flash Point | 274.3±32.9 °C |
| Exact Mass | 407.118073 |
| PSA | 77.04000 |
| LogP | 1.30 |
| Vapor Pressure | 0.0±1.4 mmHg at 25°C |
| Refractive Index | 1.590 |
Activity & Biological Data
| Target | IC50: 19 nM (DPP4)[1] |
|---|---|
| Additional Information | [1]. Thomas, L., et al. (R)-8-(3-amino-piperidin-1-yl)-7-but-2-ynyl-3-methyl-1-(4-methyl-quinazolin-2-ylmethyl)-3,7-dihydro-purine-2,6-dione (BI 1356), a novel xanthine-based dipeptidyl peptidase 4 inhibitor, has a superior potency and longer duration of action compared with other dipeptidyl peptidase-4 inhibitors. J Pharmacol Exp Ther. 2008 Apr;325(1):175-82. [2]. Kim, S.J., et al., Dipeptidyl peptidase IV inhibition with MK0431 improves islet graft survival in diabetic NOD mice partially via T-cell modulation. Diabetes, 2009. 58(3): p. 641-51. [3]. Sangle, G.V., et al., Novel biological action of the dipeptidylpeptidase-IV inhibitor, sitagliptin, as a glucagon-like peptide-1 secretagogue. Endocrinology, 2012. 153(2): p. 564-73. [4]. Kim, S.J., et al., Inhibition of dipeptidyl peptidase IV with sitagliptin (MK0431) prolongs islet graft survival in streptozotocin-induced diabetic mice. Diabetes, 2008. 57(5): p. 1331-9. [5]. Beconi, M.G., et al. Disposition of the dipeptidyl peptidase 4 inhibitor sitagliptin in rats and dogs. Drug Metab Dispos, 2007. 35(4): p. 525-32. |
Frequently Asked Questions
What is the CAS number of Sitagliptin?
The CAS number of Sitagliptin is 486460-32-6.
What are the molecular formula and molecular weight of Sitagliptin?
Sitagliptin has molecular formula C16H15F6N5O and molecular weight 407.314 g/mol.
What are the upstream and downstream products of Sitagliptin?
For Sitagliptin, Upstream Products: (2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-yl]-1-(2,4,5-trifluorophenyl)but-2-en-2-amine, (2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-one, (S)-Sitagliptin phosphate; Downstream Products: (2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-one, Sitagliptin phosphate monohydrate.
Data compiled from public chemical databases such as PubChem and supplier catalogs; supplier offers are provided by suppliers.
Last updated:
How to cite: Jingsj. "Sitagliptin (CAS 486460-32-6)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1985184-4 (accessed 2026-11-09).
Data for reference only; verify product details with suppliers before purchase.