4,6-dimethylquinoline-2(1H)-thione
TL;DR: 4,6-dimethylquinoline-2(1H)-thione (CAS 41957-23-7) 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.
4,6-dimethyl-1H-quinoline-2-thione
Also Known As: 2-thiono-6-methyllepidine, 4,6-dimethylquinoline-2-thiol, 4,6-dimethylquinoline-2(1H)-thione, 4,6-dimethyl-1H-quinoline-2-thione, 2(1H)-Quinolinethione, 4,6-dimethyl-
| 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 | 41957-23-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=S)C=C2C |
Product Overview
4,6-dimethylquinoline-2(1H)-thione (CAS 41957-23-7), with molecular formula C11H11NS and molecular weight 189.06 g/mol. IUPAC: 4,6-dimethyl-1H-quinoline-2-thione.
Chemical Property Profile of 4,6-dimethylquinoline-2(1H)-thione
Property Insights of 4,6-dimethylquinoline-2(1H)-thione
The XLogP value of 3.51423 indicates that 4,6-dimethylquinoline-2(1H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.79 Ų, 4,6-dimethylquinoline-2(1H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-dimethylquinoline-2(1H)-thione 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 4,6-dimethylquinoline-2(1H)-thione?
The CAS number of 4,6-dimethylquinoline-2(1H)-thione is 41957-23-7.
What is the molecular formula of 4,6-dimethylquinoline-2(1H)-thione?
The molecular formula of 4,6-dimethylquinoline-2(1H)-thione is C11H11NS.
What is the molecular weight of 4,6-dimethylquinoline-2(1H)-thione?
The molecular weight of 4,6-dimethylquinoline-2(1H)-thione is 189.06 g/mol.
Where can I buy 4,6-dimethylquinoline-2(1H)-thione?
You can request a quote for 4,6-dimethylquinoline-2(1H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-dimethylquinoline-2(1H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 4,6-dimethylquinoline-2(1H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.