N-(3-Methylphenyl)-2-sulfanylacetamide
TL;DR: N-(3-Methylphenyl)-2-sulfanylacetamide (CAS 35331-30-7) is a chemical compound with molecular formula C9H11NOS and molecular weight 181.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methylphenyl)-2-sulfanylacetamide
Also Known As: N-(3-Methylphenyl)-2-sulfanylacetamide, 2-Mercapto-N-m-tolylacetamide, mercapto-acetic acid m-toluidide, Acetamide, 2-mercapto-N-(3-methylphenyl)-, N-(m-tolyl)-2-sulfanyl-acetamide
| Molecular Formula | C9H11NOS |
|---|---|
| Molecular Weight | 181.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 30.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.05614 |
| Heavy Atoms | 12 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 35331-30-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CS |
| InChIKey | DTIAYBYJXZBQDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3-Methylphenyl)-2-sulfanylacetamide (CAS 35331-30-7), with molecular formula C9H11NOS and molecular weight 181.06 g/mol. IUPAC: N-(3-methylphenyl)-2-sulfanylacetamide.
Chemical Property Profile of N-(3-Methylphenyl)-2-sulfanylacetamide
Property Insights of N-(3-Methylphenyl)-2-sulfanylacetamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Methylphenyl)-2-sulfanylacetamide. With a topological polar surface area (TPSA) of 30.1 Ų, N-(3-Methylphenyl)-2-sulfanylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Methylphenyl)-2-sulfanylacetamide has 2 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 N-(3-Methylphenyl)-2-sulfanylacetamide?
The CAS number of N-(3-Methylphenyl)-2-sulfanylacetamide is 35331-30-7.
What is the molecular formula of N-(3-Methylphenyl)-2-sulfanylacetamide?
The molecular formula of N-(3-Methylphenyl)-2-sulfanylacetamide is C9H11NOS.
What is the molecular weight of N-(3-Methylphenyl)-2-sulfanylacetamide?
The molecular weight of N-(3-Methylphenyl)-2-sulfanylacetamide is 181.06 g/mol.
Where can I buy N-(3-Methylphenyl)-2-sulfanylacetamide?
You can request a quote for N-(3-Methylphenyl)-2-sulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Methylphenyl)-2-sulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Methylphenyl)-2-sulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.