N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide
TL;DR: N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide (CAS 896358-02-4) is a chemical compound with molecular formula C17H18FNOS and molecular weight 303.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,5-dimethylphenyl)-3-(4-fluorophenyl)sulfanylpropanamide
Also Known As: N-3,5-xylyl3-(p-fluorophenylthio)propionamide, F2537-1850, N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide, N-(3,5-dimethylphenyl)-3-[(4-fluorophenyl)sulfanyl]propanamide, N-(3,5-dimethylphenyl)-3-(4-fluorophenyl)sulfanylpropanamide
| Molecular Formula | C17H18FNOS |
|---|---|
| Molecular Weight | 303.11 g/mol |
| LogP | 4.56344 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.1093 |
| Heavy Atoms | 21 |
| Complexity | 604.93726 |
Chemical Identifiers
| CAS Number | 896358-02-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=O)CCSC2=CC=C(C=C2)F)C |
Product Overview
N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide (CAS 896358-02-4), with molecular formula C17H18FNOS and molecular weight 303.11 g/mol. IUPAC: N-(3,5-dimethylphenyl)-3-(4-fluorophenyl)sulfanylpropanamide.
Chemical Property Profile of N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide
Property Insights of N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide
The XLogP value of 4.56344 indicates that N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)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-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide?
The CAS number of N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide is 896358-02-4.
What is the molecular formula of N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide?
The molecular formula of N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide is C17H18FNOS.
What is the molecular weight of N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide?
The molecular weight of N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide is 303.11 g/mol.
Where can I buy N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide?
You can request a quote for N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-dimethylphenyl)-3-((4-fluorophenyl)thio)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.