![N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide structure](/static/products/3389/338956-08-4.webp)
N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide
TL;DR: N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide (CAS 338956-08-4) is a chemical compound with molecular formula C16H13BrF3NOS and molecular weight 402.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide
Also Known As: 5J-549S, N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide, N-{2-[(4-bromophenyl)sulfanyl]ethyl}-3-(trifluoromethyl)benzamide, N-{2-[(4-bromophenyl)sulfanyl]ethyl}-3-(trifluoromethyl)benzenecarboxamide
| Molecular Formula | C16H13BrF3NOS |
|---|---|
| Molecular Weight | 402.99 g/mol |
| LogP | 4.99 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.98532 |
| Heavy Atoms | 23 |
| Complexity | 673.7707 |
Chemical Identifiers
| CAS Number | 338956-08-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)NCCSC2=CC=C(C=C2)Br |
Product Overview
N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide (CAS 338956-08-4), with molecular formula C16H13BrF3NOS and molecular weight 402.99 g/mol. IUPAC: N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide.
Chemical Property Profile of N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide
Property Insights of N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide
The XLogP value of 4.99 indicates that N-[2-(4-bromophenyl)sulfanylethyl]-3-(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-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide has 1 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 N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide?
The CAS number of N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide is 338956-08-4.
What is the molecular formula of N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide?
The molecular formula of N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide is C16H13BrF3NOS.
What is the molecular weight of N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide?
The molecular weight of N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide is 402.99 g/mol.
Where can I buy N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide?
You can request a quote for N-[2-(4-bromophenyl)sulfanylethyl]-3-(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-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-bromophenyl)sulfanylethyl]-3-(trifluoromethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.