![N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide structure](/static/products/6643/664320-95-0.webp)
N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide
TL;DR: N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide (CAS 664320-95-0) is a chemical compound with molecular formula C13H17NOS and molecular weight 235.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)sulfanyl-N-prop-2-enylpropanamide
Also Known As: N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide, 2-(4-methylphenyl)sulfanyl-N-prop-2-enylpropanamide, AH-487/41826341, 2-[(4-methylphenyl)sulfanyl]-N-(prop-2-en-1-yl)propanamide
| Molecular Formula | C13H17NOS |
|---|---|
| Molecular Weight | 235.10 g/mol |
| LogP | 2.77782 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 235.10309 |
| Heavy Atoms | 16 |
| Complexity | 358.7003 |
Chemical Identifiers
| CAS Number | 664320-95-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC(C)C(=O)NCC=C |
Product Overview
N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide (CAS 664320-95-0), with molecular formula C13H17NOS and molecular weight 235.10 g/mol. IUPAC: 2-(4-methylphenyl)sulfanyl-N-prop-2-enylpropanamide.
Chemical Property Profile of N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide
Property Insights of N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide
The XLogP value of 2.77782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide 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-allyl-2-[(4-methylphenyl)sulfanyl]propanamide?
The CAS number of N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide is 664320-95-0.
What is the molecular formula of N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide?
The molecular formula of N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide is C13H17NOS.
What is the molecular weight of N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide?
The molecular weight of N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide is 235.10 g/mol.
Where can I buy N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide?
You can request a quote for N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-2-[(4-methylphenyl)sulfanyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.