TL;DR: 3-Anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 1164532-44-8) is a chemical compound with molecular formula C18H16N2O3S2 and molecular weight 372.06024 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-3-anilino-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BIM-0030856.P001, AB00095608-01, 3-anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (Z)-5-(3-ethoxy-4-hydroxybenzylidene)-3-(phenylamino)-2-thioxothiazolidin-4-one, (5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-3-(phenylamino)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C18H16N2O3S2 |
| Molecular Weight | 372.06024 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.06024 Da |
| Heavy Atoms | 25 |
| Complexity | 534.0 |
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)NC3=CC=CC=C3)O |
| InChIKey | DLRUGRPGYYZBIG-WJDWOHSUSA-N |
The XLogP value of 4.8 indicates that 3-Anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, 3-Anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 1164532-44-8.
The molecular formula of 3-Anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is C18H16N2O3S2.
The molecular weight of 3-Anilino-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 372.06024 g/mol.
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