TL;DR: Ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate (CAS 833429-58-6) is a chemical compound with molecular formula C17H17ClN2O4S and molecular weight 380.05975 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate
Also Known As: F1747-0006, ETHYL 2-[(Z)-N'-(4-CHLOROBENZENESULFONYL)-1-PHENYLMETHANIMIDAMIDO]ACETATE, ethyl N-[{[(4-chlorophenyl)sulfonyl]imino}(phenyl)methyl]glycinate, ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate, (Z)-ethyl 2-(N'-((4-chlorophenyl)sulfonyl)benzimidamido)acetate
| Molecular Formula | C17H17ClN2O4S |
| Molecular Weight | 380.05975 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 93.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.05975 Da |
| Heavy Atoms | 25 |
| Complexity | 560.0 |
| SMILES | CCOC(=O)CN=C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl |
| InChIKey | ALKQCJAYMDFGMJ-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that Ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate. Following Lipinski's Rule of Five, Ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate 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 Ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate is 833429-58-6.
The molecular formula of Ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate is C17H17ClN2O4S.
The molecular weight of Ethyl 2-[[[(4-chlorophenyl)sulfonylamino]-phenylmethylidene]amino]acetate is 380.05975 g/mol.
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