3-Chloro-3'-(trifluoromethyl)benzanilide
TL;DR: 3-Chloro-3'-(trifluoromethyl)benzanilide (CAS 4496-57-5) is a chemical compound with molecular formula C14H9ClF3NO and molecular weight 299.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[3-(trifluoromethyl)phenyl]benzamide
Also Known As: 3-chloro-N-[3-(trifluoromethyl)phenyl]benzamide, 3-CHLORO-3'-(TRIFLUOROMETHYL)BENZANILIDE, (3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]carboxamide, 662-663-8, RefChem:499832
| Molecular Formula | C14H9ClF3NO |
|---|---|
| Molecular Weight | 299.03 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.03247 |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 4496-57-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C(=O)NC2=CC=CC(=C2)C(F)(F)F |
| InChIKey | AHDMSHKQMKOWPZ-UHFFFAOYSA-N |
Product Overview
3-Chloro-3'-(trifluoromethyl)benzanilide (CAS 4496-57-5), with molecular formula C14H9ClF3NO and molecular weight 299.03 g/mol. IUPAC: 3-chloro-N-[3-(trifluoromethyl)phenyl]benzamide.
Chemical Property Profile of 3-Chloro-3'-(trifluoromethyl)benzanilide
Property Insights of 3-Chloro-3'-(trifluoromethyl)benzanilide
The XLogP value of 4.8 indicates that 3-Chloro-3'-(trifluoromethyl)benzanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Chloro-3'-(trifluoromethyl)benzanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-3'-(trifluoromethyl)benzanilide has 1 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 3-Chloro-3'-(trifluoromethyl)benzanilide?
The CAS number of 3-Chloro-3'-(trifluoromethyl)benzanilide is 4496-57-5.
What is the molecular formula of 3-Chloro-3'-(trifluoromethyl)benzanilide?
The molecular formula of 3-Chloro-3'-(trifluoromethyl)benzanilide is C14H9ClF3NO.
What is the molecular weight of 3-Chloro-3'-(trifluoromethyl)benzanilide?
The molecular weight of 3-Chloro-3'-(trifluoromethyl)benzanilide is 299.03 g/mol.
Where can I buy 3-Chloro-3'-(trifluoromethyl)benzanilide?
You can request a quote for 3-Chloro-3'-(trifluoromethyl)benzanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-3'-(trifluoromethyl)benzanilide?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-3'-(trifluoromethyl)benzanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.