2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide
TL;DR: 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide (CAS 39096-03-2) is a chemical compound with molecular formula C12H16ClNOS and molecular weight 257.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide
Also Known As: 2-[(4-chlorophenyl)thio]-N-isobutylacetamide, AB00103982-01, 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide, 2-[(4-chlorophenyl)sulfanyl]-N-(2-methylpropyl)acetamide
| Molecular Formula | C12H16ClNOS |
|---|---|
| Molecular Weight | 257.06 g/mol |
| LogP | 3.2043 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.06412 |
| Heavy Atoms | 16 |
| Complexity | 337.37692 |
Chemical Identifiers
| CAS Number | 39096-03-2 |
|---|---|
| SMILES | CC(C)CNC(=O)CSC1=CC=C(C=C1)Cl |
Product Overview
2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide (CAS 39096-03-2), with molecular formula C12H16ClNOS and molecular weight 257.06 g/mol. IUPAC: 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide.
Chemical Property Profile of 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide
Property Insights of 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide
The XLogP value of 3.2043 indicates that 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)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-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)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-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide?
The CAS number of 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide is 39096-03-2.
What is the molecular formula of 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide?
The molecular formula of 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide is C12H16ClNOS.
What is the molecular weight of 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide?
The molecular weight of 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide is 257.06 g/mol.
Where can I buy 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide?
You can request a quote for 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chlorophenyl)sulfanyl-N-(2-methylpropyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.