3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one
TL;DR: 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one (CAS 932350-97-5) is a chemical compound with molecular formula C18H15ClN2OS and molecular weight 342.05936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-chlorophenyl)methylsulfanyl]-1-(3-methylphenyl)pyrazin-2-one
Also Known As: 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one, 3-{[(4-chlorophenyl)methyl]sulfanyl}-1-(3-methylphenyl)-1,2-dihydropyrazin-2-one, F3167-0858, 3-[(4-chlorophenyl)methylsulfanyl]-1-(3-methylphenyl)pyrazin-2-one
Technical Specifications
| Molecular Formula | C18H15ClN2OS |
| Molecular Weight | 342.05936 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.05936 Da |
| Heavy Atoms | 23 |
| Complexity | 485.0 |
| SMILES | CC1=CC(=CC=C1)N2C=CN=C(C2=O)SCC3=CC=C(C=C3)Cl |
| InChIKey | BLDBVXUTSWRIJP-UHFFFAOYSA-N |
Chemical Property Profile of 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one
Property Insights of 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one
The XLogP value of 4.4 indicates that 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.0 Ų, 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one has 0 hydrogen bond donor(s) and 3 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-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one?
The CAS number of 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one is 932350-97-5.
What is the molecular formula of 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one?
The molecular formula of 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one is C18H15ClN2OS.
What is the molecular weight of 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one?
The molecular weight of 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one is 342.05936 g/mol.
Where can I buy 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one?
You can request a quote for 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for 3-((4-chlorobenzyl)thio)-1-(m-tolyl)pyrazin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.