Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate
TL;DR: Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate (CAS 53975-71-6) is a chemical compound with molecular formula C8H7N3O3 and molecular weight 193.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-oxo-2H-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylate
Also Known As: 1,2,4-Triazolo[4,3-a]pyridine-8-carboxylic acid, 2,3-dihydro-3-oxo-, methyl ester, Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo[4,3-a]pyridine-8-carboxylate, Methyl 3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxylate, 2,3-Dihydro-3-oxo-1,2,4-triazolo[4,3-a]pyridine-8-carboxylic acid methyl ester, methyl 3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylate
| Molecular Formula | C8H7N3O3 |
|---|---|
| Molecular Weight | 193.05 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.04874 |
| Heavy Atoms | 14 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 53975-71-6 |
|---|---|
| SMILES | COC(=O)C1=CC=CN2C1=NNC2=O |
| InChIKey | VFAKANVUXPLAFN-UHFFFAOYSA-N |
Product Overview
Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate (CAS 53975-71-6), with molecular formula C8H7N3O3 and molecular weight 193.05 g/mol. IUPAC: methyl 3-oxo-2H-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylate.
Chemical Property Profile of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate
Property Insights of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate. Following Lipinski's Rule of Five, Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate?
The CAS number of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate is 53975-71-6.
What is the molecular formula of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate?
The molecular formula of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate is C8H7N3O3.
What is the molecular weight of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate?
The molecular weight of Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate is 193.05 g/mol.
Where can I buy Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate?
You can request a quote for Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,3-dihydro-3-oxo-1,2,4-triazolo(4,3-a)pyridine-8-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.