(1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate
TL;DR: (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate (CAS 329762-16-5) is a chemical compound with molecular formula C22H16BrNO4S and molecular weight 469.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate
Also Known As: (1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate, 4-(4-bromophenyl)sulfonyloxy-1-methyl-3-phenyl-quinolin-2-one, 1-methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-bromobenzene-1-sulfonate
| Molecular Formula | C22H16BrNO4S |
|---|---|
| Molecular Weight | 469.00 g/mol |
| LogP | 4.7357 |
| Topological Polar Surface Area | 65.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.99835 |
| Heavy Atoms | 29 |
| Complexity | 1362.1042 |
Chemical Identifiers
| CAS Number | 329762-16-5 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=C(C1=O)C3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)Br |
Product Overview
(1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate (CAS 329762-16-5), with molecular formula C22H16BrNO4S and molecular weight 469.00 g/mol. IUPAC: (1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate.
Chemical Property Profile of (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate
Property Insights of (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate
The XLogP value of 4.7357 indicates that (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate 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 (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate. Following Lipinski's Rule of Five, (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate 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 (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate?
The CAS number of (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate is 329762-16-5.
What is the molecular formula of (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate?
The molecular formula of (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate is C22H16BrNO4S.
What is the molecular weight of (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate?
The molecular weight of (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate is 469.00 g/mol.
Where can I buy (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate?
You can request a quote for (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (1-Methyl-2-oxo-3-phenylquinolin-4-yl) 4-bromobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.