O-methyl N-acetylcarbamothioate
TL;DR: O-methyl N-acetylcarbamothioate (CAS 16696-87-0) is a chemical compound with molecular formula C4H7NO2S and molecular weight 133.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-methyl N-acetylcarbamothioate
Also Known As: O-methyl N-acetylcarbamothioate, o-Methyl acetylthiocarbamate, O-Methyl acetylcarbamothioate, o-Methyl acetylthiocarbamate #, N-(methoxymethanethioyl)acetamide
| Molecular Formula | C4H7NO2S |
|---|---|
| Molecular Weight | 133.02 g/mol |
| LogP | 0.0538 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 133.01974 |
| Heavy Atoms | 8 |
| Complexity | 112.605934 |
Chemical Identifiers
| CAS Number | 16696-87-0 |
|---|---|
| SMILES | CC(=O)NC(=S)OC |
Product Overview
O-methyl N-acetylcarbamothioate (CAS 16696-87-0), with molecular formula C4H7NO2S and molecular weight 133.02 g/mol. IUPAC: O-methyl N-acetylcarbamothioate.
Chemical Property Profile of O-methyl N-acetylcarbamothioate
Property Insights of O-methyl N-acetylcarbamothioate
The XLogP value of 0.0538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-methyl N-acetylcarbamothioate. With a topological polar surface area (TPSA) of 38.33 Ų, O-methyl N-acetylcarbamothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-methyl N-acetylcarbamothioate 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 O-methyl N-acetylcarbamothioate?
The CAS number of O-methyl N-acetylcarbamothioate is 16696-87-0.
What is the molecular formula of O-methyl N-acetylcarbamothioate?
The molecular formula of O-methyl N-acetylcarbamothioate is C4H7NO2S.
What is the molecular weight of O-methyl N-acetylcarbamothioate?
The molecular weight of O-methyl N-acetylcarbamothioate is 133.02 g/mol.
Where can I buy O-methyl N-acetylcarbamothioate?
You can request a quote for O-methyl N-acetylcarbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-methyl N-acetylcarbamothioate?
Yes, KEHONG BIO provides custom synthesis services for O-methyl N-acetylcarbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.