3-(4-ethoxyphenyl)-5-[(2-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-5-[(2-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
3-(4-ethoxyphenyl)-5-[(2-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Compound characteristics
| Compound ID: | K506-0024 |
| Compound Name: | 3-(4-ethoxyphenyl)-5-[(2-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione |
| Molecular Weight: | 494.52 |
| Molecular Formula: | C25 H22 N2 O7 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2cccc(c2)[N+]([O-])=O)S(C(=C\c2ccccc2OC)\C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4745 |
| logD: | 4.4745 |
| logSw: | -4.4562 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.673 |
| InChI Key: | BETYVEVROYAGKR-VWLOTQADSA-N |