TL;DR: 1-(2-Benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea (CAS 1024078-05-4) is a chemical compound with molecular formula C22H19ClN2O4S and molecular weight 442.0754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea
Also Known As: 1-(5-chloro-2-(phenylcarbonyl)phenyl)-1-methyl-4-((4-methylphenyl)sulfonyl)urea, 1-(2-benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea, 3-(2-benzoyl-5-chlorophenyl)-3-methyl-1-(4-methylbenzenesulfonyl)urea, 1-(2-benzoyl-5-chloro-phenyl)-1-methyl-3-(p-tolylsulfonyl)urea, 1-(2-benzoyl-5-chloro-phenyl)-1-methyl-3-(4-methylphenyl)sulfonyl-urea
| Molecular Formula | C22H19ClN2O4S |
| Molecular Weight | 442.0754 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.0754 Da |
| Heavy Atoms | 30 |
| Complexity | 709.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(C)C2=C(C=CC(=C2)Cl)C(=O)C3=CC=CC=C3 |
| InChIKey | PHVGWIZGOIMOSJ-UHFFFAOYSA-N |
The XLogP value of 4.6 indicates that 1-(2-Benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea. Following Lipinski's Rule of Five, 1-(2-Benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2-Benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea is 1024078-05-4.
The molecular formula of 1-(2-Benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea is C22H19ClN2O4S.
The molecular weight of 1-(2-Benzoyl-5-chlorophenyl)-1-methyl-3-(4-methylphenyl)sulfonylurea is 442.0754 g/mol.
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