2-(3,4-Dimethoxyphenyl)ethanethioamide
TL;DR: 2-(3,4-Dimethoxyphenyl)ethanethioamide (CAS 145736-65-8) 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.
2-(3,4-dimethoxyphenyl)ethanethioamide
Also Known As: 2-(3,4-dimethoxyphenyl)ethanethioamide, 3,4-dimethoxyphenylthioacetamide, 2-(3,4-dimethoxy)thioacetamide, 3,4-dimethoxyphenyl-thioacetamide, 3,4-Dimethoxyphenylthioacetamid
| Molecular Formula | C10H13NO2S |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | 1.5324 |
| Topological Polar Surface Area | 44.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.0667 |
| Heavy Atoms | 14 |
| Complexity | 338.89392 |
Chemical Identifiers
| CAS Number | 145736-65-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC(=S)N)OC |
Product Overview
2-(3,4-Dimethoxyphenyl)ethanethioamide (CAS 145736-65-8), with molecular formula C10H13NO2S and molecular weight 211.07 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)ethanethioamide.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)ethanethioamide
Property Insights of 2-(3,4-Dimethoxyphenyl)ethanethioamide
The XLogP value of 1.5324 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethoxyphenyl)ethanethioamide. With a topological polar surface area (TPSA) of 44.48 Ų, 2-(3,4-Dimethoxyphenyl)ethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)ethanethioamide 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 2-(3,4-Dimethoxyphenyl)ethanethioamide?
The CAS number of 2-(3,4-Dimethoxyphenyl)ethanethioamide is 145736-65-8.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)ethanethioamide?
The molecular formula of 2-(3,4-Dimethoxyphenyl)ethanethioamide is C10H13NO2S.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)ethanethioamide?
The molecular weight of 2-(3,4-Dimethoxyphenyl)ethanethioamide is 211.07 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)ethanethioamide?
You can request a quote for 2-(3,4-Dimethoxyphenyl)ethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethoxyphenyl)ethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)ethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.