3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline
TL;DR: 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline (CAS 866895-77-4) is a chemical compound with molecular formula C24H18FNO4S and molecular weight 435.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-ethoxyphenyl)sulfonyl-6-fluoroquinolin-3-yl]-phenylmethanone
Also Known As: 3-BENZOYL-4-(4-ETHOXYBENZENESULFONYL)-6-FLUOROQUINOLINE, F1607-0584, (4-((4-ethoxyphenyl)sulfonyl)-6-fluoroquinolin-3-yl)(phenyl)methanone, [4-(4-ethoxyphenyl)sulfonyl-6-fluoroquinolin-3-yl]-phenylmethanone
| Molecular Formula | C24H18FNO4S |
|---|---|
| Molecular Weight | 435.09 g/mol |
| LogP | 4.8364 |
| Topological Polar Surface Area | 73.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.09406 |
| Heavy Atoms | 31 |
| Complexity | 1368.3811 |
Chemical Identifiers
| CAS Number | 866895-77-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)S(=O)(=O)C2=C3C=C(C=CC3=NC=C2C(=O)C4=CC=CC=C4)F |
Product Overview
3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline (CAS 866895-77-4), with molecular formula C24H18FNO4S and molecular weight 435.09 g/mol. IUPAC: [4-(4-ethoxyphenyl)sulfonyl-6-fluoroquinolin-3-yl]-phenylmethanone.
Chemical Property Profile of 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline
Property Insights of 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline
The XLogP value of 4.8364 indicates that 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline 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-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline. Following Lipinski's Rule of Five, 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline 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 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline?
The CAS number of 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline is 866895-77-4.
What is the molecular formula of 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline?
The molecular formula of 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline is C24H18FNO4S.
What is the molecular weight of 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline?
The molecular weight of 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline is 435.09 g/mol.
Where can I buy 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline?
You can request a quote for 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzoyl-4-(4-ethoxybenzenesulfonyl)-6-fluoroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.