4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline
TL;DR: 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline (CAS 866871-50-3) is a chemical compound with molecular formula C22H25N3O2S and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-ethylpiperazin-1-yl)-3-(4-methylphenyl)sulfonylquinoline
Also Known As: 4-(4-ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline, 4-(4-ethylpiperazin-1-yl)-3-(4-methylphenyl)sulfonylquinoline, F1607-0235
| Molecular Formula | C22H25N3O2S |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 3.51792 |
| Topological Polar Surface Area | 53.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.16675 |
| Heavy Atoms | 28 |
| Complexity | 1086.4698 |
Chemical Identifiers
| CAS Number | 866871-50-3 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C(C=NC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C |
Product Overview
4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline (CAS 866871-50-3), with molecular formula C22H25N3O2S and molecular weight 395.17 g/mol. IUPAC: 4-(4-ethylpiperazin-1-yl)-3-(4-methylphenyl)sulfonylquinoline.
Chemical Property Profile of 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline
Property Insights of 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline
The XLogP value of 3.51792 indicates that 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.51 Ų, 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline has 0 hydrogen bond donor(s) and 5 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-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline?
The CAS number of 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline is 866871-50-3.
What is the molecular formula of 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline?
The molecular formula of 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline is C22H25N3O2S.
What is the molecular weight of 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline?
The molecular weight of 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline is 395.17 g/mol.
Where can I buy 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline?
You can request a quote for 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Ethylpiperazin-1-yl)-3-(4-methylbenzenesulfonyl)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.