1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate
TL;DR: 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate (CAS 110216-91-6) 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.
(1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-methylbenzenesulfonate
Also Known As: (1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-methylbenzenesulfonate, J2.515.804K, 1-Methyl-3-phenyl-4-tosyloxy-2(1H)-chinolon, 1-Methyl-3-phenyl-4-tosyl- oxy-2(1H)-chinolon, 2(1H)-Quinolinone, 1-methyl-4-[[(4-methylphenyl)sulfonyl]oxy]-3-phenyl-
| Molecular Formula | C23H19NO4S |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 4.28162 |
| Topological Polar Surface Area | 65.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.1035 |
| Heavy Atoms | 29 |
| Complexity | 1356.1698 |
Chemical Identifiers
| CAS Number | 110216-91-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)N(C3=CC=CC=C32)C)C4=CC=CC=C4 |
Product Overview
1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate (CAS 110216-91-6), with molecular formula C23H19NO4S and molecular weight 405.10 g/mol. IUPAC: (1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate
Property Insights of 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate
The XLogP value of 4.28162 indicates that 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate 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-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate. Following Lipinski's Rule of Five, 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate 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-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate?
The CAS number of 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate is 110216-91-6.
What is the molecular formula of 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate?
The molecular formula of 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate is C23H19NO4S.
What is the molecular weight of 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate?
The molecular weight of 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate is 405.10 g/mol.
Where can I buy 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate?
You can request a quote for 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate 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-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-oxo-3-phenyl-1,2-dihydroquinolin-4-yl 4-methylbenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.