S-(4-Acetamidophenyl) dimethylcarbamothioate
TL;DR: S-(4-Acetamidophenyl) dimethylcarbamothioate (CAS 13512-00-0) is a chemical compound with molecular formula C11H14N2O2S and molecular weight 238.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-(4-acetamidophenyl) N,N-dimethylcarbamothioate
Also Known As: S-(4-Acetamidophenyl) dimethylcarbamothioate, S-(4-acetamidophenyl) N,N-dimethylcarbamothioate, N-[4-(dimethylcarbamoylsulfanyl)phenyl]acetamide, S-[4-(acetylamino)phenyl] dimethylcarbamothioate, S-(N-acetyl-para-aminophenyl) N,N-dimethylthiocarbamate
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H14N2O2S |
| Molecular Weight | 238.0776 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0776 Da |
| Heavy Atoms | 16 |
| Complexity | 261.0 |
| SMILES | CC(=O)NC1=CC=C(C=C1)SC(=O)N(C)C |
| InChIKey | DXTWPJONCJWDHY-UHFFFAOYSA-N |
Chemical Property Profile of S-(4-Acetamidophenyl) dimethylcarbamothioate
Property Insights of S-(4-Acetamidophenyl) dimethylcarbamothioate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(4-Acetamidophenyl) dimethylcarbamothioate. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(4-Acetamidophenyl) dimethylcarbamothioate. Following Lipinski's Rule of Five, S-(4-Acetamidophenyl) dimethylcarbamothioate 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
What is the CAS number of S-(4-Acetamidophenyl) dimethylcarbamothioate?
The CAS number of S-(4-Acetamidophenyl) dimethylcarbamothioate is 13512-00-0.
What is the molecular formula of S-(4-Acetamidophenyl) dimethylcarbamothioate?
The molecular formula of S-(4-Acetamidophenyl) dimethylcarbamothioate is C11H14N2O2S.
What is the molecular weight of S-(4-Acetamidophenyl) dimethylcarbamothioate?
The molecular weight of S-(4-Acetamidophenyl) dimethylcarbamothioate is 238.0776 g/mol.
Where can I buy S-(4-Acetamidophenyl) dimethylcarbamothioate?
You can request a quote for S-(4-Acetamidophenyl) dimethylcarbamothioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for S-(4-Acetamidophenyl) dimethylcarbamothioate?
Yes, CoreyChem provides custom synthesis services for S-(4-Acetamidophenyl) dimethylcarbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.