(3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate
TL;DR: (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate (CAS 277299-01-1) is a chemical compound with molecular formula C23H19NO4S and molecular weight 405.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate
Also Known As: (3-benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate, 4-(benzenesulfonyloxy)-3-benzyl-1-methyl-quinolin-2-one, 3-Benzyl-1-methyl-2-oxo-1,2-dihydroquinolin-4-yl benzenesulfonate
| Molecular Formula | C23H19NO4S |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 3.897 |
| Topological Polar Surface Area | 65.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.1035 |
| Heavy Atoms | 29 |
| Complexity | 1328.1814 |
Chemical Identifiers
| CAS Number | 277299-01-1 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=C(C1=O)CC3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4 |
Product Overview
(3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate (CAS 277299-01-1), with molecular formula C23H19NO4S and molecular weight 405.10 g/mol. IUPAC: (3-benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate.
Chemical Property Profile of (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate
Property Insights of (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate
The XLogP value of 3.897 indicates that (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.37 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate. Following Lipinski's Rule of Five, (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate 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 (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate?
The CAS number of (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate is 277299-01-1.
What is the molecular formula of (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate?
The molecular formula of (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate is C23H19NO4S.
What is the molecular weight of (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate?
The molecular weight of (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate is 405.10 g/mol.
Where can I buy (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate?
You can request a quote for (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (3-Benzyl-1-methyl-2-oxoquinolin-4-yl) benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.