![2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide structure](/static/products/7691/76911-84-7.webp)
2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide
TL;DR: 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide (CAS 76911-84-7) is a chemical compound with molecular formula C16H17NOS and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methylphenyl)methylsulfanyl]-N-phenylacetamide
Also Known As: TimTec1_002728, 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide, 2-[(4-methylbenzyl)thio]-N-phenylacetamide, 2-[(4-methylphenyl)methylsulfanyl]-N-phenylacetamide, 2-(4-Methyl-benzylsulfanyl)-N-phenyl-acetamide
| Molecular Formula | C16H17NOS |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.1031 |
| Heavy Atoms | 19 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 76911-84-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSCC(=O)NC2=CC=CC=C2 |
| InChIKey | PVMMVJSOUHDUFL-UHFFFAOYSA-N |
Product Overview
2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide (CAS 76911-84-7), with molecular formula C16H17NOS and molecular weight 271.10 g/mol. IUPAC: 2-[(4-methylphenyl)methylsulfanyl]-N-phenylacetamide.
Chemical Property Profile of 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide
Property Insights of 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide
The XLogP value of 3.6 indicates that 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide 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-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide?
The CAS number of 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide is 76911-84-7.
What is the molecular formula of 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide?
The molecular formula of 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide is C16H17NOS.
What is the molecular weight of 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide?
The molecular weight of 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide is 271.10 g/mol.
Where can I buy 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide?
You can request a quote for 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-methylbenzyl)sulfanyl]-N-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.