N-(2-Methoxyphenyl)ethanethioamide
TL;DR: N-(2-Methoxyphenyl)ethanethioamide (CAS 29277-46-1) is a chemical compound with molecular formula C9H11NOS and molecular weight 181.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyphenyl)ethanethioamide
Also Known As: N-(2-Methoxyphenyl)ethanethioamide, Thioacetamide, N-2-methoxyphenyl, ETH007, N-(2-Methoxyphenyl)ethanethioamide #, Ethanethioamide, N-(2-methoxyphenyl)-
| Molecular Formula | C9H11NOS |
|---|---|
| Molecular Weight | 181.06 g/mol |
| LogP | 2.4544 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.05614 |
| Heavy Atoms | 12 |
| Complexity | 285.61197 |
Chemical Identifiers
| CAS Number | 29277-46-1 |
|---|---|
| SMILES | CC(=S)NC1=CC=CC=C1OC |
Product Overview
N-(2-Methoxyphenyl)ethanethioamide (CAS 29277-46-1), with molecular formula C9H11NOS and molecular weight 181.06 g/mol. IUPAC: N-(2-methoxyphenyl)ethanethioamide.
Chemical Property Profile of N-(2-Methoxyphenyl)ethanethioamide
Property Insights of N-(2-Methoxyphenyl)ethanethioamide
The XLogP value of 2.4544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Methoxyphenyl)ethanethioamide. With a topological polar surface area (TPSA) of 21.26 Ų, N-(2-Methoxyphenyl)ethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Methoxyphenyl)ethanethioamide has 1 hydrogen bond donor(s) and 2 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 N-(2-Methoxyphenyl)ethanethioamide?
The CAS number of N-(2-Methoxyphenyl)ethanethioamide is 29277-46-1.
What is the molecular formula of N-(2-Methoxyphenyl)ethanethioamide?
The molecular formula of N-(2-Methoxyphenyl)ethanethioamide is C9H11NOS.
What is the molecular weight of N-(2-Methoxyphenyl)ethanethioamide?
The molecular weight of N-(2-Methoxyphenyl)ethanethioamide is 181.06 g/mol.
Where can I buy N-(2-Methoxyphenyl)ethanethioamide?
You can request a quote for N-(2-Methoxyphenyl)ethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Methoxyphenyl)ethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methoxyphenyl)ethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.