3-(4-ethoxyphenyl)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
3-(4-ethoxyphenyl)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Compound characteristics
| Compound ID: | K506-0021 |
| Compound Name: | 3-(4-ethoxyphenyl)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione |
| Molecular Weight: | 510.52 |
| Molecular Formula: | C25 H22 N2 O8 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2cccc(c2)[N+]([O-])=O)S(C(=C\c2ccc(c(c2)O)OC)\C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5862 |
| logD: | 3.5834 |
| logSw: | -3.4769 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.221 |
| InChI Key: | LNKICYFZMXUPEP-VWLOTQADSA-N |