4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline
TL;DR: 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline (CAS 866895-49-0) is a chemical compound with molecular formula C25H21NO5S and molecular weight 447.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(benzenesulfonyl)-6-methoxyquinolin-3-yl]-(4-ethoxyphenyl)methanone
Also Known As: 4-(benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline, F1607-0556, (4-ethoxyphenyl)(6-methoxy-4-(phenylsulfonyl)quinolin-3-yl)methanone, [4-(benzenesulfonyl)-6-methoxyquinolin-3-yl]-(4-ethoxyphenyl)methanone
| Molecular Formula | C25H21NO5S |
|---|---|
| Molecular Weight | 447.11 g/mol |
| LogP | 4.7059 |
| Topological Polar Surface Area | 82.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 447.11404 |
| Heavy Atoms | 32 |
| Complexity | 1381.5458 |
Chemical Identifiers
| CAS Number | 866895-49-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)C2=CN=C3C=CC(=CC3=C2S(=O)(=O)C4=CC=CC=C4)OC |
Product Overview
4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline (CAS 866895-49-0), with molecular formula C25H21NO5S and molecular weight 447.11 g/mol. IUPAC: [4-(benzenesulfonyl)-6-methoxyquinolin-3-yl]-(4-ethoxyphenyl)methanone.
Chemical Property Profile of 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline
Property Insights of 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline
The XLogP value of 4.7059 indicates that 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline. Following Lipinski's Rule of Five, 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline has 0 hydrogen bond donor(s) and 6 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-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline?
The CAS number of 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline is 866895-49-0.
What is the molecular formula of 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline?
The molecular formula of 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline is C25H21NO5S.
What is the molecular weight of 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline?
The molecular weight of 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline is 447.11 g/mol.
Where can I buy 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline?
You can request a quote for 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzenesulfonyl)-3-(4-ethoxybenzoyl)-6-methoxyquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.