2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester
TL;DR: 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester (CAS 347367-48-0) is a chemical compound with molecular formula C13H11NO3 and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2-oxo-1-pyridinyl)benzoate
Also Known As: methyl 2-(2-oxopyridin-1-yl)benzoate, methyl 2-(2-oxopyridin-1(2h)-yl)benzoate, J1.538.604E, 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester, methyl 2-(2-oxo-1,2-dihydropyridin-1-yl)benzoate
| Molecular Formula | C13H11NO3 |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 1.6241 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.0739 |
| Heavy Atoms | 17 |
| Complexity | 601.3636 |
Chemical Identifiers
| CAS Number | 347367-48-0 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1N2C=CC=CC2=O |
Product Overview
2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester (CAS 347367-48-0), with molecular formula C13H11NO3 and molecular weight 229.07 g/mol. IUPAC: methyl 2-(2-oxo-1-pyridinyl)benzoate.
Chemical Property Profile of 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester
Property Insights of 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester
The XLogP value of 1.6241 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester. With a topological polar surface area (TPSA) of 48.3 Ų, 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester has 0 hydrogen bond donor(s) and 3 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 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester?
The CAS number of 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester is 347367-48-0.
What is the molecular formula of 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester?
The molecular formula of 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester is C13H11NO3.
What is the molecular weight of 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester?
The molecular weight of 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester is 229.07 g/mol.
Where can I buy 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester?
You can request a quote for 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Oxo-2H-pyridin-1-yl)benzoic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.