N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide
TL;DR: N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide (CAS 131096-89-4) is a chemical compound with molecular formula C16H13ClF3NO2 and molecular weight 343.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxybenzamide
Also Known As: Cholera Toxin B Subunit, CTB ACT activator, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxybenzamide, Cholera Toxin B subunit, solid, CTB
| Molecular Formula | C16H13ClF3NO2 |
|---|---|
| Molecular Weight | 343.06 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.0587 |
| Heavy Atoms | 23 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 131096-89-4 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F |
| InChIKey | YDXZSNHARVUYNM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide (CAS 131096-89-4), with molecular formula C16H13ClF3NO2 and molecular weight 343.06 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxybenzamide.
Chemical Property Profile of N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide
Property Insights of N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide
The XLogP value of 4.6 indicates that N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide has 1 hydrogen bond donor(s) and 5 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 N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide?
The CAS number of N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide is 131096-89-4.
What is the molecular formula of N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide?
The molecular formula of N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide is C16H13ClF3NO2.
What is the molecular weight of N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide?
The molecular weight of N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide is 343.06 g/mol.
Where can I buy N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide?
You can request a quote for N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chloro-3-trifluoromethyl-phenyl)-2-ethoxy-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.