4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide
TL;DR: 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide (CAS 861452-10-0) is a chemical compound with molecular formula C16H16FNOS and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide
Also Known As: 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide, 4-fluoro-N-{2-[(4-methylphenyl)sulfanyl]ethyl}benzamide, (4-fluorophenyl)-N-[2-(4-methylphenylthio)ethyl]carboxamide
| Molecular Formula | C16H16FNOS |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 3.65622 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.09366 |
| Heavy Atoms | 20 |
| Complexity | 566.03564 |
Chemical Identifiers
| CAS Number | 861452-10-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)F |
Product Overview
4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide (CAS 861452-10-0), with molecular formula C16H16FNOS and molecular weight 289.09 g/mol. IUPAC: 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide.
Chemical Property Profile of 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide
Property Insights of 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide
The XLogP value of 3.65622 indicates that 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]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, 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]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 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide?
The CAS number of 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide is 861452-10-0.
What is the molecular formula of 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide?
The molecular formula of 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide is C16H16FNOS.
What is the molecular weight of 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide?
The molecular weight of 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide is 289.09 g/mol.
Where can I buy 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide?
You can request a quote for 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-fluoro-N-[2-(4-methylphenyl)sulfanylethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.