4,8-Dimethylquinoline-2-thiol
TL;DR: 4,8-Dimethylquinoline-2-thiol (CAS 53761-60-7) is a chemical compound with molecular formula C11H11NS and molecular weight 189.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8-dimethyl-1H-quinoline-2-thione
Also Known As: 4,8-dimethylquinoline-2-thiol, 4,8-dimethyl-1H-quinoline-2-thione, 4,8-Dimethyl-chinolin-2-thiol, 4,8-dimethyl-quinoline-2-thiol, 4,8-dimethylhydroquinoline-2-thione
| Molecular Formula | C11H11NS |
|---|---|
| Molecular Weight | 189.06 g/mol |
| LogP | 3.51423 |
| Topological Polar Surface Area | 15.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.06122 |
| Heavy Atoms | 13 |
| Complexity | 510.96948 |
Chemical Identifiers
| CAS Number | 53761-60-7 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=CC(=S)N2)C |
Product Overview
4,8-Dimethylquinoline-2-thiol (CAS 53761-60-7), with molecular formula C11H11NS and molecular weight 189.06 g/mol. IUPAC: 4,8-dimethyl-1H-quinoline-2-thione.
Chemical Property Profile of 4,8-Dimethylquinoline-2-thiol
Property Insights of 4,8-Dimethylquinoline-2-thiol
The XLogP value of 3.51423 indicates that 4,8-Dimethylquinoline-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.79 Ų, 4,8-Dimethylquinoline-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,8-Dimethylquinoline-2-thiol has 1 hydrogen bond donor(s) and 1 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 4,8-Dimethylquinoline-2-thiol?
The CAS number of 4,8-Dimethylquinoline-2-thiol is 53761-60-7.
What is the molecular formula of 4,8-Dimethylquinoline-2-thiol?
The molecular formula of 4,8-Dimethylquinoline-2-thiol is C11H11NS.
What is the molecular weight of 4,8-Dimethylquinoline-2-thiol?
The molecular weight of 4,8-Dimethylquinoline-2-thiol is 189.06 g/mol.
Where can I buy 4,8-Dimethylquinoline-2-thiol?
You can request a quote for 4,8-Dimethylquinoline-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,8-Dimethylquinoline-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 4,8-Dimethylquinoline-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.