n-Methyl-n-phenyl-2-sulfanylacetamide
TL;DR: n-Methyl-n-phenyl-2-sulfanylacetamide (CAS 58721-68-9) 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-methyl-N-phenyl-2-sulfanylacetamide
Also Known As: n-methyl-n-phenyl-2-sulfanylacetamide, 2-mercapto-N-methyl-N-phenylacetamide, 2-mercapto-N-methyl-N-phenyl-acetamide
| Molecular Formula | C9H11NOS |
|---|---|
| Molecular Weight | 181.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.05614 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 58721-68-9 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)CS |
| InChIKey | ONRCNAXJWPLLHV-UHFFFAOYSA-N |
Product Overview
n-Methyl-n-phenyl-2-sulfanylacetamide (CAS 58721-68-9), with molecular formula C9H11NOS and molecular weight 181.06 g/mol. IUPAC: N-methyl-N-phenyl-2-sulfanylacetamide.
Chemical Property Profile of n-Methyl-n-phenyl-2-sulfanylacetamide
Property Insights of n-Methyl-n-phenyl-2-sulfanylacetamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Methyl-n-phenyl-2-sulfanylacetamide. With a topological polar surface area (TPSA) of 21.3 Ų, n-Methyl-n-phenyl-2-sulfanylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Methyl-n-phenyl-2-sulfanylacetamide 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 n-Methyl-n-phenyl-2-sulfanylacetamide?
The CAS number of n-Methyl-n-phenyl-2-sulfanylacetamide is 58721-68-9.
What is the molecular formula of n-Methyl-n-phenyl-2-sulfanylacetamide?
The molecular formula of n-Methyl-n-phenyl-2-sulfanylacetamide is C9H11NOS.
What is the molecular weight of n-Methyl-n-phenyl-2-sulfanylacetamide?
The molecular weight of n-Methyl-n-phenyl-2-sulfanylacetamide is 181.06 g/mol.
Where can I buy n-Methyl-n-phenyl-2-sulfanylacetamide?
You can request a quote for n-Methyl-n-phenyl-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-Methyl-n-phenyl-2-sulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for n-Methyl-n-phenyl-2-sulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.