TL;DR: Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester (CAS 116943-58-9) is a chemical compound with molecular formula C15H15ClN2O4S and molecular weight 354.0441 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloroethyl N-(diphenylsulfamoyl)carbamate
Also Known As: 2-Chloroethyl ((diphenylamino)sulfonyl)carbamate, Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester, 2-Chloroethyl (diphenylsulfamoyl)carbamate, N-(Chloro-2 ethoxycarbonyl) N',N'-(diphenyl) sulfamide, 2-chloroethyl N-(diphenylsulfamoyl)carbamate
| Molecular Formula | C15H15ClN2O4S |
| Molecular Weight | 354.0441 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 84.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 354.0441 Da |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
| SMILES | C1=CC=C(C=C1)N(C2=CC=CC=C2)S(=O)(=O)NC(=O)OCCCl |
| InChIKey | ZSXZSNWLAREGOP-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester 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 Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester. Following Lipinski's Rule of Five, Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester 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 Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester is 116943-58-9.
The molecular formula of Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester is C15H15ClN2O4S.
The molecular weight of Carbamic acid, ((diphenylamino)sulfonyl)-, 2-chloroethyl ester is 354.0441 g/mol.
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