2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid
TL;DR: 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid (CAS 24063-30-7) is a chemical compound with molecular formula C15H9ClF3NO3 and molecular weight 343.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]benzoic acid
Also Known As: Maybridge1_001147, 2-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid, 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]benzoic acid, Benzoicacid, 2-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-, F3268-0101
| Molecular Formula | C15H9ClF3NO3 |
|---|---|
| Molecular Weight | 343.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.0223 |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 24063-30-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C(=O)O |
| InChIKey | AJQDUVANDXBKQI-UHFFFAOYSA-N |
Product Overview
2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid (CAS 24063-30-7), with molecular formula C15H9ClF3NO3 and molecular weight 343.02 g/mol. IUPAC: 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]benzoic acid.
Chemical Property Profile of 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid
Property Insights of 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid
The XLogP value of 3.8 indicates that 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid. Following Lipinski's Rule of Five, 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid has 2 hydrogen bond donor(s) and 6 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-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid?
The CAS number of 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid is 24063-30-7.
What is the molecular formula of 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid?
The molecular formula of 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid is C15H9ClF3NO3.
What is the molecular weight of 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid?
The molecular weight of 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid is 343.02 g/mol.
Where can I buy 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid?
You can request a quote for 2-{[2-Chloro-5-(trifluoromethyl)phenyl]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-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-Chloro-5-(trifluoromethyl)phenyl]carbamoyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.