![N-[2-(4-Methylphenylthio)ethyl]propionamide structure](/static/products/827/82772-76-7.png)
N-[2-(4-Methylphenylthio)ethyl]propionamide
TL;DR: N-[2-(4-Methylphenylthio)ethyl]propionamide (CAS 82772-76-7) is a chemical compound with molecular formula C12H17NOS and molecular weight 223.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-methylphenyl)sulfanylethyl]propanamide
Also Known As: N-[2-(4-Methylphenylthio)ethyl]propionamide, N-(2-((4-methylphenyl)thio)ethyl)propanamide, N-[2-(4-methylphenylthio)ethyl]propanamide, N-(2-(4-Methylphenylthio)ethyl)propionamide, N-{2-[(4-methylphenyl)sulfanyl]ethyl}propanamide
| Molecular Formula | C12H17NOS |
|---|---|
| Molecular Weight | 223.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 223.10309 |
| Heavy Atoms | 15 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 82772-76-7 |
|---|---|
| SMILES | CCC(=O)NCCSC1=CC=C(C=C1)C |
| InChIKey | PGQPABUDWJJDLT-UHFFFAOYSA-N |
Product Overview
N-[2-(4-Methylphenylthio)ethyl]propionamide (CAS 82772-76-7), with molecular formula C12H17NOS and molecular weight 223.10 g/mol. IUPAC: N-[2-(4-methylphenyl)sulfanylethyl]propanamide.
Chemical Property Profile of N-[2-(4-Methylphenylthio)ethyl]propionamide
Property Insights of N-[2-(4-Methylphenylthio)ethyl]propionamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(4-Methylphenylthio)ethyl]propionamide. With a topological polar surface area (TPSA) of 54.4 Ų, N-[2-(4-Methylphenylthio)ethyl]propionamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(4-Methylphenylthio)ethyl]propionamide 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-(4-Methylphenylthio)ethyl]propionamide?
The CAS number of N-[2-(4-Methylphenylthio)ethyl]propionamide is 82772-76-7.
What is the molecular formula of N-[2-(4-Methylphenylthio)ethyl]propionamide?
The molecular formula of N-[2-(4-Methylphenylthio)ethyl]propionamide is C12H17NOS.
What is the molecular weight of N-[2-(4-Methylphenylthio)ethyl]propionamide?
The molecular weight of N-[2-(4-Methylphenylthio)ethyl]propionamide is 223.10 g/mol.
Where can I buy N-[2-(4-Methylphenylthio)ethyl]propionamide?
You can request a quote for N-[2-(4-Methylphenylthio)ethyl]propionamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(4-Methylphenylthio)ethyl]propionamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-Methylphenylthio)ethyl]propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.