![2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid structure](/static/products/3532/353254-62-3.webp)
2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid
TL;DR: 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid (CAS 353254-62-3) is a chemical compound with molecular formula C15H12FNO3 and molecular weight 273.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-fluoro-4-methylphenyl)carbamoyl]benzoic acid
Also Known As: 2-[(3-fluoro-4-methylphenyl)carbamoyl]benzoic acid, 2-((3-fluoro-4-methylphenyl)carbamoyl)benzoic acid, 2-[(3-Fluoro-4-methylanilino)carbonyl]benzoic acid, 2-[(3-Fluoro-4-methylanilino)carbonyl]benzoic acid #, 2-{[(3-fluoro-4-methylphenyl)amino]carbonyl}benzoic acid
| Molecular Formula | C15H12FNO3 |
|---|---|
| Molecular Weight | 273.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.0801 |
| Heavy Atoms | 20 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 353254-62-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O)F |
| InChIKey | PJVKLESMNNGPSK-UHFFFAOYSA-N |
Product Overview
2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid (CAS 353254-62-3), with molecular formula C15H12FNO3 and molecular weight 273.08 g/mol. IUPAC: 2-[(3-fluoro-4-methylphenyl)carbamoyl]benzoic acid.
Chemical Property Profile of 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid
Property Insights of 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid. Following Lipinski's Rule of Five, 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid has 2 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 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid?
The CAS number of 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid is 353254-62-3.
What is the molecular formula of 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid?
The molecular formula of 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid is C15H12FNO3.
What is the molecular weight of 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid?
The molecular weight of 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid is 273.08 g/mol.
Where can I buy 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid?
You can request a quote for 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Fluoro-4-methylphenyl)carbamoyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.