TL;DR: N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride (CAS 1052524-24-9) is a chemical compound with molecular formula C21H29ClN2O3S and molecular weight 424.15875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-hydroxy-3-pyrrolidin-1-ylpropyl)-4-methyl-N-(4-methylphenyl)benzenesulfonamide;hydrochloride
Also Known As: N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride, N-(2-hydroxy-3-pyrrolidin-1-ylpropyl)-4-methyl-N-(4-methylphenyl)benzenesulfonamide hydrochloride
| Molecular Formula | C21H29ClN2O3S |
| Molecular Weight | 424.15875 g/mol |
| XLogP | 3.37724 |
| Topological Polar Surface Area (TPSA) | 69.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.15875 Da |
| Heavy Atoms | 28 |
| Complexity | 540.0 |
| SMILES | CC1=CC=C(C=C1)N(CC(CN2CCCC2)O)S(=O)(=O)C3=CC=C(C=C3)C.Cl |
| InChIKey | CWWKCLPPYYIZLL-UHFFFAOYSA-N |
The XLogP value of 3.37724 indicates that N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride. Following Lipinski's Rule of Five, N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride is 1052524-24-9.
The molecular formula of N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride is C21H29ClN2O3S.
The molecular weight of N-(2-hydroxy-3-(pyrrolidin-1-yl)propyl)-4-methyl-N-(p-tolyl)benzenesulfonamide hydrochloride is 424.15875 g/mol.
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