![O-[2-(dimethylamino)ethyl] benzenecarbothioate structure](/static/products/1336/13365-68-9.webp)
O-[2-(dimethylamino)ethyl] benzenecarbothioate
TL;DR: O-[2-(dimethylamino)ethyl] benzenecarbothioate (CAS 13365-68-9) is a chemical compound with molecular formula C11H15NOS and molecular weight 209.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-[2-(dimethylamino)ethyl] benzenecarbothioate
Also Known As: 2-dimethylaminoethoxy-phenyl-methanethione, O-[2-(dimethylamino)ethyl] benzenecarbothioate, O-(2-dimethylaminoethyl) benzenecarbothioate
| Molecular Formula | C11H15NOS |
|---|---|
| Molecular Weight | 209.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 44.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.08743 |
| Heavy Atoms | 14 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 13365-68-9 |
|---|---|
| SMILES | CN(C)CCOC(=S)C1=CC=CC=C1 |
| InChIKey | AKRSXCDTAKBRLC-UHFFFAOYSA-N |
Product Overview
O-[2-(dimethylamino)ethyl] benzenecarbothioate (CAS 13365-68-9), with molecular formula C11H15NOS and molecular weight 209.09 g/mol. IUPAC: O-[2-(dimethylamino)ethyl] benzenecarbothioate.
Chemical Property Profile of O-[2-(dimethylamino)ethyl] benzenecarbothioate
Property Insights of O-[2-(dimethylamino)ethyl] benzenecarbothioate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-[2-(dimethylamino)ethyl] benzenecarbothioate. With a topological polar surface area (TPSA) of 44.6 Ų, O-[2-(dimethylamino)ethyl] benzenecarbothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-[2-(dimethylamino)ethyl] benzenecarbothioate 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-[2-(dimethylamino)ethyl] benzenecarbothioate?
The CAS number of O-[2-(dimethylamino)ethyl] benzenecarbothioate is 13365-68-9.
What is the molecular formula of O-[2-(dimethylamino)ethyl] benzenecarbothioate?
The molecular formula of O-[2-(dimethylamino)ethyl] benzenecarbothioate is C11H15NOS.
What is the molecular weight of O-[2-(dimethylamino)ethyl] benzenecarbothioate?
The molecular weight of O-[2-(dimethylamino)ethyl] benzenecarbothioate is 209.09 g/mol.
Where can I buy O-[2-(dimethylamino)ethyl] benzenecarbothioate?
You can request a quote for O-[2-(dimethylamino)ethyl] benzenecarbothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-[2-(dimethylamino)ethyl] benzenecarbothioate?
Yes, KEHONG BIO provides custom synthesis services for O-[2-(dimethylamino)ethyl] benzenecarbothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.