3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline
TL;DR: 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline (CAS 866895-56-9) is a chemical compound with molecular formula C26H23NO4S and molecular weight 445.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethoxyphenyl)-[4-(4-ethylphenyl)sulfonylquinolin-3-yl]methanone
Also Known As: 3-(4-ETHOXYBENZOYL)-4-(4-ETHYLBENZENESULFONYL)QUINOLINE, F1607-0563, (4-ethoxyphenyl)(4-((4-ethylphenyl)sulfonyl)quinolin-3-yl)methanone, (4-ethoxyphenyl)-[4-(4-ethylphenyl)sulfonylquinolin-3-yl]methanone
| Molecular Formula | C26H23NO4S |
|---|---|
| Molecular Weight | 445.13 g/mol |
| LogP | 5.2597 |
| Topological Polar Surface Area | 73.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.13477 |
| Heavy Atoms | 32 |
| Complexity | 1376.0404 |
Chemical Identifiers
| CAS Number | 866895-56-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)S(=O)(=O)C2=C(C=NC3=CC=CC=C32)C(=O)C4=CC=C(C=C4)OCC |
Product Overview
3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline (CAS 866895-56-9), with molecular formula C26H23NO4S and molecular weight 445.13 g/mol. IUPAC: (4-ethoxyphenyl)-[4-(4-ethylphenyl)sulfonylquinolin-3-yl]methanone.
Chemical Property Profile of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline
Property Insights of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline
The XLogP value of 5.2597 indicates that 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline. Following Lipinski's Rule of Five, 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline?
The CAS number of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline is 866895-56-9.
What is the molecular formula of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline?
The molecular formula of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline is C26H23NO4S.
What is the molecular weight of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline?
The molecular weight of 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline is 445.13 g/mol.
Where can I buy 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline?
You can request a quote for 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Ethoxybenzoyl)-4-(4-ethylbenzenesulfonyl)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.