![1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid structure](/static/products/4399/4399-77-3.webp)
1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid
TL;DR: 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid (CAS 4399-77-3) is a chemical compound with molecular formula C13H10ClNO3 and molecular weight 263.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methyl]-6-oxopyridine-3-carboxylic acid
Also Known As: 1-(2-chlorobenzyl)-6-oxo-1,6-dihydro-3-pyridinecarboxylic acid, 1-(2-chlorobenzyl)-6-oxo-1,6-dihydropyridine-3-carboxylic acid, 1-[(2-chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid, 1-[(2-chlorophenyl)methyl]-6-oxopyridine-3-carboxylic acid, Benzenamine,4-bromo-N-(1-methylethyl)-2-nitro-
| Molecular Formula | C13H10ClNO3 |
|---|---|
| Molecular Weight | 263.03 g/mol |
| LogP | 2.2482 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.0349 |
| Heavy Atoms | 18 |
| Complexity | 648.67975 |
Chemical Identifiers
| CAS Number | 4399-77-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C=C(C=CC2=O)C(=O)O)Cl |
Product Overview
1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid (CAS 4399-77-3), with molecular formula C13H10ClNO3 and molecular weight 263.03 g/mol. IUPAC: 1-[(2-chlorophenyl)methyl]-6-oxopyridine-3-carboxylic acid.
Chemical Property Profile of 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid
Property Insights of 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid
The XLogP value of 2.2482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid. With a topological polar surface area (TPSA) of 59.3 Ų, 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid has 1 hydrogen bond donor(s) and 2 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 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
The CAS number of 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid is 4399-77-3.
What is the molecular formula of 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
The molecular formula of 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid is C13H10ClNO3.
What is the molecular weight of 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
The molecular weight of 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid is 263.03 g/mol.
Where can I buy 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
You can request a quote for 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Chlorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.