8-Ethylsulfanylsulfonylquinoline
TL;DR: 8-Ethylsulfanylsulfonylquinoline (CAS 330156-91-7) is a chemical compound with molecular formula C11H11NO2S2 and molecular weight 253.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-ethylsulfanylsulfonylquinoline
Also Known As: 8-ethylsulfanylsulfonylquinoline, 8-(ethylthio)sulfonylquinoline, S-ethyl quinoline-8-sulfonothioate, Quinoline-8-thiosulfonic acid S-ethyl ester
| Molecular Formula | C11H11NO2S2 |
|---|---|
| Molecular Weight | 253.02 g/mol |
| LogP | 2.6766 |
| Topological Polar Surface Area | 47.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.02312 |
| Heavy Atoms | 16 |
| Complexity | 602.9156 |
Chemical Identifiers
| CAS Number | 330156-91-7 |
|---|---|
| SMILES | CCSS(=O)(=O)C1=CC=CC2=C1N=CC=C2 |
Product Overview
8-Ethylsulfanylsulfonylquinoline (CAS 330156-91-7), with molecular formula C11H11NO2S2 and molecular weight 253.02 g/mol. IUPAC: 8-ethylsulfanylsulfonylquinoline.
Chemical Property Profile of 8-Ethylsulfanylsulfonylquinoline
Property Insights of 8-Ethylsulfanylsulfonylquinoline
The XLogP value of 2.6766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Ethylsulfanylsulfonylquinoline. With a topological polar surface area (TPSA) of 47.03 Ų, 8-Ethylsulfanylsulfonylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Ethylsulfanylsulfonylquinoline has 0 hydrogen bond donor(s) and 4 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 8-Ethylsulfanylsulfonylquinoline?
The CAS number of 8-Ethylsulfanylsulfonylquinoline is 330156-91-7.
What is the molecular formula of 8-Ethylsulfanylsulfonylquinoline?
The molecular formula of 8-Ethylsulfanylsulfonylquinoline is C11H11NO2S2.
What is the molecular weight of 8-Ethylsulfanylsulfonylquinoline?
The molecular weight of 8-Ethylsulfanylsulfonylquinoline is 253.02 g/mol.
Where can I buy 8-Ethylsulfanylsulfonylquinoline?
You can request a quote for 8-Ethylsulfanylsulfonylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Ethylsulfanylsulfonylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-Ethylsulfanylsulfonylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.