2-(4-Methylphenyl)ethanethioamide
TL;DR: 2-(4-Methylphenyl)ethanethioamide (CAS 97426-53-4) is a chemical compound with molecular formula C9H11NS and molecular weight 165.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)ethanethioamide
Also Known As: 2-(4-methylphenyl)ethanethioamide, 2-(p-Tolyl)thioacetamide, 2- ethanethioamide, 2-(p-Tolyl)ethanethioamide, Maybridge1_003524
| Molecular Formula | C9H11NS |
|---|---|
| Molecular Weight | 165.06 g/mol |
| LogP | 1.82362 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.06122 |
| Heavy Atoms | 11 |
| Complexity | 250.77017 |
Chemical Identifiers
| CAS Number | 97426-53-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC(=S)N |
Product Overview
2-(4-Methylphenyl)ethanethioamide (CAS 97426-53-4), with molecular formula C9H11NS and molecular weight 165.06 g/mol. IUPAC: 2-(4-methylphenyl)ethanethioamide.
Chemical Property Profile of 2-(4-Methylphenyl)ethanethioamide
Property Insights of 2-(4-Methylphenyl)ethanethioamide
The XLogP value of 1.82362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methylphenyl)ethanethioamide. With a topological polar surface area (TPSA) of 26.02 Ų, 2-(4-Methylphenyl)ethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methylphenyl)ethanethioamide has 1 hydrogen bond donor(s) and 1 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-(4-Methylphenyl)ethanethioamide?
The CAS number of 2-(4-Methylphenyl)ethanethioamide is 97426-53-4.
What is the molecular formula of 2-(4-Methylphenyl)ethanethioamide?
The molecular formula of 2-(4-Methylphenyl)ethanethioamide is C9H11NS.
What is the molecular weight of 2-(4-Methylphenyl)ethanethioamide?
The molecular weight of 2-(4-Methylphenyl)ethanethioamide is 165.06 g/mol.
Where can I buy 2-(4-Methylphenyl)ethanethioamide?
You can request a quote for 2-(4-Methylphenyl)ethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methylphenyl)ethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylphenyl)ethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.