4-Chloro-2-methyl-8-methylsulfanylquinoline
TL;DR: 4-Chloro-2-methyl-8-methylsulfanylquinoline (CAS 6961-40-6) is a chemical compound with molecular formula C11H10ClNS and molecular weight 223.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-methyl-8-methylsulfanylquinoline
Also Known As: 4-chloro-2-methyl-8-methylsulfanylquinoline, 4-chloro-2-methyl-8-(methylsulfanyl)quinoline, 4-Chloro-2-methyl-8-(methylthio)quinoline, Quinoline,4-chloro-2-methyl-8-(methylthio)-, 8-Chloro-4-hydroxy-5-methoxyquinoline
| Molecular Formula | C11H10ClNS |
|---|---|
| Molecular Weight | 223.02 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.02225 |
| Heavy Atoms | 14 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 6961-40-6 |
|---|---|
| SMILES | CC1=CC(=C2C=CC=C(C2=N1)SC)Cl |
| InChIKey | RVOOGDIEOOFFGT-UHFFFAOYSA-N |
Product Overview
4-Chloro-2-methyl-8-methylsulfanylquinoline (CAS 6961-40-6), with molecular formula C11H10ClNS and molecular weight 223.02 g/mol. IUPAC: 4-chloro-2-methyl-8-methylsulfanylquinoline.
Chemical Property Profile of 4-Chloro-2-methyl-8-methylsulfanylquinoline
Property Insights of 4-Chloro-2-methyl-8-methylsulfanylquinoline
The XLogP value of 3.7 indicates that 4-Chloro-2-methyl-8-methylsulfanylquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.2 Ų, 4-Chloro-2-methyl-8-methylsulfanylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-methyl-8-methylsulfanylquinoline has 0 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 4-Chloro-2-methyl-8-methylsulfanylquinoline?
The CAS number of 4-Chloro-2-methyl-8-methylsulfanylquinoline is 6961-40-6.
What is the molecular formula of 4-Chloro-2-methyl-8-methylsulfanylquinoline?
The molecular formula of 4-Chloro-2-methyl-8-methylsulfanylquinoline is C11H10ClNS.
What is the molecular weight of 4-Chloro-2-methyl-8-methylsulfanylquinoline?
The molecular weight of 4-Chloro-2-methyl-8-methylsulfanylquinoline is 223.02 g/mol.
Where can I buy 4-Chloro-2-methyl-8-methylsulfanylquinoline?
You can request a quote for 4-Chloro-2-methyl-8-methylsulfanylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-methyl-8-methylsulfanylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-methyl-8-methylsulfanylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.