![2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide structure](/static/products/5991/599160-29-9.webp)
2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide
TL;DR: 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide (CAS 599160-29-9) is a chemical compound with molecular formula C17H18FNOS and molecular weight 303.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-N-[2-(4-fluorophenyl)ethyl]acetamide
Also Known As: 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide, 2-benzylsulfanyl-N-[2-(4-fluorophenyl)ethyl]acetamide, N-[2-(4-fluorophenyl)ethyl]-2-(phenylmethylthio)acetamide
| Molecular Formula | C17H18FNOS |
|---|---|
| Molecular Weight | 303.11 g/mol |
| LogP | 3.4178 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 303.1093 |
| Heavy Atoms | 21 |
| Complexity | 556.76263 |
Chemical Identifiers
| CAS Number | 599160-29-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCC(=O)NCCC2=CC=C(C=C2)F |
Product Overview
2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide (CAS 599160-29-9), with molecular formula C17H18FNOS and molecular weight 303.11 g/mol. IUPAC: 2-benzylsulfanyl-N-[2-(4-fluorophenyl)ethyl]acetamide.
Chemical Property Profile of 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide
Property Insights of 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide
The XLogP value of 3.4178 indicates that 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide 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 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The CAS number of 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide is 599160-29-9.
What is the molecular formula of 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The molecular formula of 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide is C17H18FNOS.
What is the molecular weight of 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The molecular weight of 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide is 303.11 g/mol.
Where can I buy 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide?
You can request a quote for 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(benzylsulfanyl)-N-[2-(4-fluorophenyl)ethyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.