TL;DR: BAS 04191153 (CAS 460066-13-1) is a chemical compound with molecular formula C22H23ClN2O4S and molecular weight 446.10672 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(oxolan-2-ylmethyl)benzenesulfonamide
Also Known As: BAS 04191153, AB01303482-01, 4-chloro-N-((2-hydroxy-8-methylquinolin-3-yl)methyl)-N-((tetrahydrofuran-2-yl)methyl)benzenesulfonamide, 4-chloro-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide, 4-chloro-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(oxolan-2-ylmethyl)benzenesulfonamide
| Molecular Formula | C22H23ClN2O4S |
| Molecular Weight | 446.10672 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 84.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.10672 Da |
| Heavy Atoms | 30 |
| Complexity | 758.0 |
| SMILES | CC1=C2C(=CC=C1)C=C(C(=O)N2)CN(CC3CCCO3)S(=O)(=O)C4=CC=C(C=C4)Cl |
| InChIKey | VUSMUHSEZZCBFL-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that BAS 04191153 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04191153. Following Lipinski's Rule of Five, BAS 04191153 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 04191153 is 460066-13-1.
The molecular formula of BAS 04191153 is C22H23ClN2O4S.
The molecular weight of BAS 04191153 is 446.10672 g/mol.
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