![2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide structure](/static/products/7048/704879-41-4.webp)
2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide
TL;DR: 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide (CAS 704879-41-4) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(cyanomethylsulfanyl)-N-(2-methoxyphenyl)acetamide
Also Known As: CBKinase1_011218, CBKinase1_023618, 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide, 2-(cyanomethylthio)-N-(2-methoxyphenyl)acetamide, 2-((cyanomethyl)thio)-N-(2-methoxyphenyl)acetamide
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 1.89048 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 401.2162 |
Chemical Identifiers
| CAS Number | 704879-41-4 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)CSCC#N |
Product Overview
2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide (CAS 704879-41-4), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: 2-(cyanomethylsulfanyl)-N-(2-methoxyphenyl)acetamide.
Chemical Property Profile of 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Property Insights of 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide
The XLogP value of 1.89048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide. Following Lipinski's Rule of Five, 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide has 1 hydrogen bond donor(s) and 4 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-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide?
The CAS number of 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide is 704879-41-4.
What is the molecular formula of 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide?
The molecular formula of 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide is C11H12N2O2S.
What is the molecular weight of 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide?
The molecular weight of 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide is 236.06 g/mol.
Where can I buy 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide?
You can request a quote for 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(cyanomethyl)sulfanyl]-N-(2-methoxyphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.