![N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide structure](/static/products/7041/70413-87-5.webp)
N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide
TL;DR: N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide (CAS 70413-87-5) is a chemical compound with molecular formula C13H16N2O3S and molecular weight 280.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-acetyl-2-[2-[acetyl(methyl)amino]phenyl]sulfanylacetamide
Also Known As: N-acetyl-2-[2-[acetyl(methyl)amino]phenyl]sulfanylacetamide, N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide
| Molecular Formula | C13H16N2O3S |
|---|---|
| Molecular Weight | 280.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.08817 |
| Heavy Atoms | 19 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 70413-87-5 |
|---|---|
| SMILES | CC(=O)NC(=O)CSC1=CC=CC=C1N(C)C(=O)C |
| InChIKey | HCNQMCPHFHNXMF-UHFFFAOYSA-N |
Product Overview
N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide (CAS 70413-87-5), with molecular formula C13H16N2O3S and molecular weight 280.09 g/mol. IUPAC: N-acetyl-2-[2-[acetyl(methyl)amino]phenyl]sulfanylacetamide.
Chemical Property Profile of N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide
Property Insights of N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide. Following Lipinski's Rule of Five, N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide 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 N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide?
The CAS number of N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide is 70413-87-5.
What is the molecular formula of N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide?
The molecular formula of N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide is C13H16N2O3S.
What is the molecular weight of N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide?
The molecular weight of N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide is 280.09 g/mol.
Where can I buy N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide?
You can request a quote for N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(2-Acetamido-2-oxoethyl)sulfanyl]phenyl}-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.