N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide
TL;DR: N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide (CAS 773152-15-1) is a chemical compound with molecular formula C11H11ClN2OS and molecular weight 254.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide
Also Known As: N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide, AP-906/42838183, N-(4-chloro-2-methylphenyl)-2-[(cyanomethyl)sulfanyl]acetamide, N-(4-chloro-2-methylphenyl)-2-(cyanomethylthio)acetamide
| Molecular Formula | C11H11ClN2OS |
|---|---|
| Molecular Weight | 254.03 g/mol |
| LogP | 2.8437 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.02806 |
| Heavy Atoms | 16 |
| Complexity | 428.483 |
Chemical Identifiers
| CAS Number | 773152-15-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)NC(=O)CSCC#N |
Product Overview
N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide (CAS 773152-15-1), with molecular formula C11H11ClN2OS and molecular weight 254.03 g/mol. IUPAC: N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide.
Chemical Property Profile of N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide
Property Insights of N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide
The XLogP value of 2.8437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide has 1 hydrogen bond donor(s) and 3 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-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide?
The CAS number of N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide is 773152-15-1.
What is the molecular formula of N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide?
The molecular formula of N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide is C11H11ClN2OS.
What is the molecular weight of N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide?
The molecular weight of N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide is 254.03 g/mol.
Where can I buy N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide?
You can request a quote for N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-2-methylphenyl)-2-(cyanomethylsulfanyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.