TL;DR: 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione (CAS 151956-14-8) is a chemical compound with molecular formula C19H14ClNO3S and molecular weight 371.0383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5E)-3-[2-(4-chlorophenyl)-2-oxoethyl]-5-[(4-methylphenyl)methylidene]-1,3-thiazolidine-2,4-dione
Also Known As: 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione, 2,4-Thiazolidinedione, 3-(2-(4-chlorophenyl)-2-oxoethyl)-5-((4-methylphenyl)methylene)-, 3-(2-(4-Chlorophenyl)-2-oxoethyl)-5-((4-methylphenyl)methylene)-2,4-thiazolidinedione, 3-(4-Chloro-beta-oxophenethyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione, (5E)-3-[2-(4-chlorophenyl)-2-oxoethyl]-5-[(4-methylphenyl)methylidene]-1,3-thiazolidine-2,4-dione
| Molecular Formula | C19H14ClNO3S |
| Molecular Weight | 371.0383 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 79.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.0383 Da |
| Heavy Atoms | 25 |
| Complexity | 575.0 |
| SMILES | CC1=CC=C(C=C1)/C=C/2\C(=O)N(C(=O)S2)CC(=O)C3=CC=C(C=C3)Cl |
| InChIKey | OHUJPPORGJUZPD-LICLKQGHSA-N |
The XLogP value of 4.8 indicates that 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione. Following Lipinski's Rule of Five, 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione has 0 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 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione is 151956-14-8.
The molecular formula of 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione is C19H14ClNO3S.
The molecular weight of 3-(4-Chlorophenacyl)-5-(4-methylbenzylidene)thiazolidine-2,4-dione is 371.0383 g/mol.
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