N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide
TL;DR: N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide (CAS 15360-37-9) is a chemical compound with molecular formula C11H8ClF6NO and molecular weight 319.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloroethyl)-3,5-bis(trifluoromethyl)benzamide
Also Known As: N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide, Benzamide, N-(2-chloroethyl)-3,5-bis(trifluoromethyl)-, 9H-Xanthene-2,7-diol,1,3,4,5,6,8-hexamethyl-9-(1-methylethyl), RefChem:161704
| Molecular Formula | C11H8ClF6NO |
|---|---|
| Molecular Weight | 319.02 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.01987 |
| Heavy Atoms | 20 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 15360-37-9 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)NCCCl |
| InChIKey | BYDONUYJMAYHFP-UHFFFAOYSA-N |
Product Overview
N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide (CAS 15360-37-9), with molecular formula C11H8ClF6NO and molecular weight 319.02 g/mol. IUPAC: N-(2-chloroethyl)-3,5-bis(trifluoromethyl)benzamide.
Chemical Property Profile of N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide
Property Insights of N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide
The XLogP value of 3.6 indicates that N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide has 1 hydrogen bond donor(s) and 7 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-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide?
The CAS number of N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide is 15360-37-9.
What is the molecular formula of N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide?
The molecular formula of N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide is C11H8ClF6NO.
What is the molecular weight of N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide?
The molecular weight of N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide is 319.02 g/mol.
Where can I buy N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide?
You can request a quote for N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chloroethyl)-3,5-bis(trifluoromethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.