N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide
TL;DR: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide (CAS 896306-44-8) is a chemical compound with molecular formula C17H18N2OS2 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-methylphenyl)sulfanylpropanamide
Also Known As: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide, F2590-0118, N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-[(4-methylphenyl)sulfanyl]propanamide, N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-methylphenyl)sulfanylpropanamide
| Molecular Formula | C17H18N2OS2 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 4.66594 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.08606 |
| Heavy Atoms | 22 |
| Complexity | 711.49554 |
Chemical Identifiers
| CAS Number | 896306-44-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCCC(=O)NC2=C(C(=C(S2)C)C)C#N |
Product Overview
N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide (CAS 896306-44-8), with molecular formula C17H18N2OS2 and molecular weight 330.09 g/mol. IUPAC: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-methylphenyl)sulfanylpropanamide.
Chemical Property Profile of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide
Property Insights of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide
The XLogP value of 4.66594 indicates that N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide has 1 hydrogen bond donor(s) and 4 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-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide?
The CAS number of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide is 896306-44-8.
What is the molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide?
The molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide is C17H18N2OS2.
What is the molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide?
The molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide is 330.09 g/mol.
Where can I buy N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide?
You can request a quote for N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(p-tolylthio)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.