TL;DR: 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1) (CAS 113712-91-7) is a chemical compound with molecular formula C14H22ClN3O4S and molecular weight 363.10196 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)sulfonyl-3-propan-2-ylurea;morpholine
Also Known As: 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1), Benzenesulfonamide, 4-chloro-N-(((1-methylethyl)amino)carbonyl)-, compd. with morpholine (1:1), 1-(4-chlorophenyl)sulfonyl-3-propan-2-ylurea;morpholine, 1-(4-chlorophenyl)sulfonyl-3-propan-2-ylurea; morpholine, 4-Chloro-N-[(propan-2-yl)carbamoyl]benzene-1-sulfonamide--morpholine (1/1)
| Molecular Formula | C14H22ClN3O4S |
| Molecular Weight | 363.10196 g/mol |
| XLogP | 1.3425 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.10196 Da |
| Heavy Atoms | 23 |
| Complexity | 391.0 |
| SMILES | CC(C)NC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl.C1COCCN1 |
| InChIKey | DYOCSQKYOSIXAJ-UHFFFAOYSA-N |
The XLogP value of 1.3425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1). The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1). Following Lipinski's Rule of Five, 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1) has 3 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 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1) is 113712-91-7.
The molecular formula of 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1) is C14H22ClN3O4S.
The molecular weight of 4-Chloro-N-(((1-methylethyl)amino)carbonyl)benzenesulfonamide compd. with morpholine (1:1) is 363.10196 g/mol.
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