butyl 4-[({5-[(2-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)amino]benzoate
Chemical Structure Depiction of
butyl 4-[({5-[(2-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)amino]benzoate
butyl 4-[({5-[(2-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)amino]benzoate
Compound characteristics
| Compound ID: | 8003-6330 |
| Compound Name: | butyl 4-[({5-[(2-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)amino]benzoate |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C22 H21 Cl N2 O4 S |
| Smiles: | CCCCOC(c1ccc(cc1)NCN1C(/C(=C\c2ccccc2[Cl])SC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2987 |
| logD: | 6.2987 |
| logSw: | -6.0768 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.803 |
| InChI Key: | ONSJYXKQPBRQOZ-UHFFFAOYSA-N |