TL;DR: 1-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea (CAS 10080-04-3) is a chemical compound with molecular formula C15H17N3O3S and molecular weight 319.09906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]urea
Also Known As: aromatic sulfonamide compound 21, Urea, 1-phenyl-3-(p-sulfamoylphenethyl)-, 1-phenyl-3-[2-(4-sulfamoylphenyl)ethyl]urea, 1-(4-Sulfamoylphenethyl)-3-phenylurea, 1-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea
| Molecular Formula | C15H17N3O3S |
| Molecular Weight | 319.09906 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.09906 Da |
| Heavy Atoms | 22 |
| Complexity | 447.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N |
| InChIKey | CQMWNAHSFVPGJL-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea. Following Lipinski's Rule of Five, 1-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea has 3 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-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea is 10080-04-3.
The molecular formula of 1-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea is C15H17N3O3S.
The molecular weight of 1-Phenyl-3-(2-(4-sulfamoylphenyl)ethyl)urea is 319.09906 g/mol.
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