Vildagliptin

• CAS: 274901-16-5
• Catalog Number: ACM274901165
• Category: Inhibitors
• Molecular Weight: 303.4
• Molecular Formula: C₁₇H₂₅N₃O₂
• Description: Vildagliptin (LAF237) is a potent, stable, selective dipeptidyl peptidase IV (DPP-IV) inhibitor with an IC50 of 3.5 nM in human Caco-2 cells. Vildagliptin possesses excellent oral bioavailability and potent antihyperglycemic activity.
• Synonyms: Unii-I6B4B2U96p; Laf 237; Galvus
• IUPAC Name: (2S)-1-[2-[(3-hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carbonitrile
• Canonical SMILES: C1CC(N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C#N
• InChI Key: SYOKIDBDQMKNDQ-XWTIBIIYSA-N
• Boiling Point: 531.3ºC at 760 mmHg
• Flash Point: 275.1ºC
• Density: 1.27 g/cm³
• Appearance: white crystalline powder
• Storage: Powder-20°C, 3 years; 4°C, 2 years; In solvent-80°C, 6 months; -20°C, 1 month.
• Exact Mass: 303.19500
• Shipping: Can be shipped at room temperature, where not in use may vary.

Custom Q&A

What is the PubChem CID of vildagliptin?

The PubChem CID of vildagliptin is 6918537.

What is the molecular formula of vildagliptin?

The molecular formula of vildagliptin is C17H25N3O2.

What is the molecular weight of vildagliptin?

The molecular weight of vildagliptin is 303.4 g/mol.

What is the IUPAC name of vildagliptin?

The IUPAC name of vildagliptin is (2S)-1-[2-[(3-hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carbonitrile.

What is the InChIKey of vildagliptin?

The InChIKey of vildagliptin is SYOKIDBDQMKNDQ-XWTIBIIYSA-N.

What is the canonical SMILES of vildagliptin?

The canonical SMILES of vildagliptin is C1CC(N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C#N.

What is the CAS number of vildagliptin?

The CAS number of vildagliptin is 274901-16-5.

What is the European Community (EC) number of vildagliptin?

The European Community (EC) number of vildagliptin is 630-410-0.

What is the KEGG ID of vildagliptin?

The KEGG ID of vildagliptin is D07080.

What is the Wikipedia page for vildagliptin?

The Wikipedia page for vildagliptin is "Vildagliptin".

Synthetic Use

Upstream Synthesis Route 1

• 702-82-9
• 207557-35-5

• 274901-16-5

Reference: [1]Letters in Organic Chemistry,2014,vol. 11,p. 780 - 784

Downstream Synthesis Route 1

• 274901-16-5

• 924914-75-0

Reference: [1]Patent: WO2007/19255,2007,A2 .Location in patent: Page/Page column 38-39

Downstream Synthesis Route 2

• 274901-16-5

• 924667-83-4

Reference: [1]Patent: WO2007/19255,2007,A2 .Location in patent: Page/Page column 39

* For details of the synthesis route, please refer to the original source to ensure accuracy.