3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide
TL;DR: 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide (CAS 557756-12-4) is a chemical compound with molecular formula C17H18ClNOS and molecular weight 319.07977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-chlorophenyl)sulfanyl-N-(3,5-dimethylphenyl)propanamide
Also Known As: 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide, 3-(4-chlorophenyl)sulfanyl-N-(3,5-dimethylphenyl)propanamide, 3-[(4-CHLOROPHENYL)SULFANYL]-N-(3,5-DIMETHYLPHENYL)PROPANAMIDE, F2537-1017
Technical Specifications
| Molecular Formula | C17H18ClNOS |
| Molecular Weight | 319.07977 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.07977 Da |
| Heavy Atoms | 21 |
| Complexity | 321.0 |
| SMILES | CC1=CC(=CC(=C1)NC(=O)CCSC2=CC=C(C=C2)Cl)C |
| InChIKey | ULUJEHZNIVJHDW-UHFFFAOYSA-N |
Chemical Property Profile of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide
Property Insights of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide
The XLogP value of 4.6 indicates that 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)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
What is the CAS number of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide?
The CAS number of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide is 557756-12-4.
What is the molecular formula of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide?
The molecular formula of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide is C17H18ClNOS.
What is the molecular weight of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide?
The molecular weight of 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide is 319.07977 g/mol.
Where can I buy 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide?
You can request a quote for 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide?
Yes, CoreyChem provides custom synthesis services for 3-((4-chlorophenyl)thio)-N-(3,5-dimethylphenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.