4-Methylsulfanylquinoline
TL;DR: 4-Methylsulfanylquinoline (CAS 46000-25-3) is a chemical compound with molecular formula C10H9NS and molecular weight 175.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanylquinoline
Also Known As: 4-methylsulfanylquinoline, 4-(methylthio)quinoline, 4-Methylthioquinoline, 4-(METHYLSULFANYL)QUINOLINE, 4-methylthioisoquinoline
| Molecular Formula | C10H9NS |
|---|---|
| Molecular Weight | 175.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.04558 |
| Heavy Atoms | 12 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 46000-25-3 |
|---|---|
| SMILES | CSC1=CC=NC2=CC=CC=C21 |
| InChIKey | UPWGLVMHTJEWLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methylsulfanylquinoline (CAS 46000-25-3), with molecular formula C10H9NS and molecular weight 175.05 g/mol. IUPAC: 4-methylsulfanylquinoline.
Chemical Property Profile of 4-Methylsulfanylquinoline
Property Insights of 4-Methylsulfanylquinoline
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylsulfanylquinoline. With a topological polar surface area (TPSA) of 38.2 Ų, 4-Methylsulfanylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-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-Methylsulfanylquinoline?
The CAS number of 4-Methylsulfanylquinoline is 46000-25-3.
What is the molecular formula of 4-Methylsulfanylquinoline?
The molecular formula of 4-Methylsulfanylquinoline is C10H9NS.
What is the molecular weight of 4-Methylsulfanylquinoline?
The molecular weight of 4-Methylsulfanylquinoline is 175.05 g/mol.
Where can I buy 4-Methylsulfanylquinoline?
You can request a quote for 4-Methylsulfanylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylsulfanylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylsulfanylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.