O-(4-Methoxyphenyl) dimethylcarbamothioate
TL;DR: O-(4-Methoxyphenyl) dimethylcarbamothioate (CAS 10345-49-0) is a chemical compound with molecular formula C10H13NO2S and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-(4-methoxyphenyl) N,N-dimethylcarbamothioate
Also Known As: O-(4-Methoxyphenyl) dimethylcarbamothioate, Dimethylthiocarbamic acid 4-methoxyphenyl ester, O-(4-methoxyphenyl) N,N-dimethylcarbamothioate, 4-methoxyphenyl-O,N,N-dimethyl thiocarbamate, J1.628.052F
| Molecular Formula | C10H13NO2S |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 53.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.0667 |
| Heavy Atoms | 14 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 10345-49-0 |
|---|---|
| SMILES | CN(C)C(=S)OC1=CC=C(C=C1)OC |
| InChIKey | RGDRZVIHLSIYND-UHFFFAOYSA-N |
Product Overview
O-(4-Methoxyphenyl) dimethylcarbamothioate (CAS 10345-49-0), with molecular formula C10H13NO2S and molecular weight 211.07 g/mol. IUPAC: O-(4-methoxyphenyl) N,N-dimethylcarbamothioate.
Chemical Property Profile of O-(4-Methoxyphenyl) dimethylcarbamothioate
Property Insights of O-(4-Methoxyphenyl) dimethylcarbamothioate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-(4-Methoxyphenyl) dimethylcarbamothioate. With a topological polar surface area (TPSA) of 53.8 Ų, O-(4-Methoxyphenyl) dimethylcarbamothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-(4-Methoxyphenyl) dimethylcarbamothioate has 0 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-(4-Methoxyphenyl) dimethylcarbamothioate?
The CAS number of O-(4-Methoxyphenyl) dimethylcarbamothioate is 10345-49-0.
What is the molecular formula of O-(4-Methoxyphenyl) dimethylcarbamothioate?
The molecular formula of O-(4-Methoxyphenyl) dimethylcarbamothioate is C10H13NO2S.
What is the molecular weight of O-(4-Methoxyphenyl) dimethylcarbamothioate?
The molecular weight of O-(4-Methoxyphenyl) dimethylcarbamothioate is 211.07 g/mol.
Where can I buy O-(4-Methoxyphenyl) dimethylcarbamothioate?
You can request a quote for O-(4-Methoxyphenyl) dimethylcarbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-(4-Methoxyphenyl) dimethylcarbamothioate?
Yes, KEHONG BIO provides custom synthesis services for O-(4-Methoxyphenyl) dimethylcarbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.