2-[(3-Fluorophenyl)carbamoyl]benzoic acid
TL;DR: 2-[(3-Fluorophenyl)carbamoyl]benzoic acid (CAS 19336-76-6) is a chemical compound with molecular formula C14H10FNO3 and molecular weight 259.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-fluorophenyl)carbamoyl]benzoic acid
Also Known As: 2-[(3-fluorophenyl)carbamoyl]benzoic acid, 2-[(3-fluoroanilino)carbonyl]benzoic acid, Benzoic acid,2-[[(3-fluorophenyl)amino]carbonyl]-, 2-[N-(3-fluorophenyl)carbamoyl]benzoic acid, 2-[[(3-FLUOROPHENYL)AMINO]CARBONYL]-BENZOIC ACID
| Molecular Formula | C14H10FNO3 |
|---|---|
| Molecular Weight | 259.06 g/mol |
| LogP | 2.7762 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.06448 |
| Heavy Atoms | 19 |
| Complexity | 640.09314 |
Chemical Identifiers
| CAS Number | 19336-76-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)F)C(=O)O |
Product Overview
2-[(3-Fluorophenyl)carbamoyl]benzoic acid (CAS 19336-76-6), with molecular formula C14H10FNO3 and molecular weight 259.06 g/mol. IUPAC: 2-[(3-fluorophenyl)carbamoyl]benzoic acid.
Chemical Property Profile of 2-[(3-Fluorophenyl)carbamoyl]benzoic acid
Property Insights of 2-[(3-Fluorophenyl)carbamoyl]benzoic acid
The XLogP value of 2.7762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-Fluorophenyl)carbamoyl]benzoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Fluorophenyl)carbamoyl]benzoic acid. Following Lipinski's Rule of Five, 2-[(3-Fluorophenyl)carbamoyl]benzoic acid has 2 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 2-[(3-Fluorophenyl)carbamoyl]benzoic acid?
The CAS number of 2-[(3-Fluorophenyl)carbamoyl]benzoic acid is 19336-76-6.
What is the molecular formula of 2-[(3-Fluorophenyl)carbamoyl]benzoic acid?
The molecular formula of 2-[(3-Fluorophenyl)carbamoyl]benzoic acid is C14H10FNO3.
What is the molecular weight of 2-[(3-Fluorophenyl)carbamoyl]benzoic acid?
The molecular weight of 2-[(3-Fluorophenyl)carbamoyl]benzoic acid is 259.06 g/mol.
Where can I buy 2-[(3-Fluorophenyl)carbamoyl]benzoic acid?
You can request a quote for 2-[(3-Fluorophenyl)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-Fluorophenyl)carbamoyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Fluorophenyl)carbamoyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.