S-(2-acetamidophenyl) ethanethioate
TL;DR: S-(2-acetamidophenyl) ethanethioate (CAS 1204-55-3) is a chemical compound with molecular formula C10H11NO2S and molecular weight 209.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-acetamidophenyl) ethanethioate
Also Known As: S-(2-acetamidophenyl) ethanethioate, 2-Acetylamino-S-acetylthiophenol, 2-Aminothiophenol, N,S-diacetyl-, S-(2-acetamidophenyl) ethanethioat, S-[2-(acetylamino)phenyl] ethanethioate
| Molecular Formula | C10H11NO2S |
|---|---|
| Molecular Weight | 209.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.05106 |
| Heavy Atoms | 14 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 1204-55-3 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC=C1SC(=O)C |
| InChIKey | YQGDQHHQENADMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
S-(2-acetamidophenyl) ethanethioate (CAS 1204-55-3), with molecular formula C10H11NO2S and molecular weight 209.05 g/mol. IUPAC: S-(2-acetamidophenyl) ethanethioate.
Chemical Property Profile of S-(2-acetamidophenyl) ethanethioate
Property Insights of S-(2-acetamidophenyl) ethanethioate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-acetamidophenyl) ethanethioate. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-acetamidophenyl) ethanethioate. Following Lipinski's Rule of Five, S-(2-acetamidophenyl) ethanethioate 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 S-(2-acetamidophenyl) ethanethioate?
The CAS number of S-(2-acetamidophenyl) ethanethioate is 1204-55-3.
What is the molecular formula of S-(2-acetamidophenyl) ethanethioate?
The molecular formula of S-(2-acetamidophenyl) ethanethioate is C10H11NO2S.
What is the molecular weight of S-(2-acetamidophenyl) ethanethioate?
The molecular weight of S-(2-acetamidophenyl) ethanethioate is 209.05 g/mol.
Where can I buy S-(2-acetamidophenyl) ethanethioate?
You can request a quote for S-(2-acetamidophenyl) ethanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-acetamidophenyl) ethanethioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-acetamidophenyl) ethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.