3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1lambda~6~,3-thiazolidine-1,1,4-trione
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1lambda~6~,3-thiazolidine-1,1,4-trione
3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1lambda~6~,3-thiazolidine-1,1,4-trione
Compound characteristics
| Compound ID: | K506-0038 |
| Compound Name: | 3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1lambda~6~,3-thiazolidine-1,1,4-trione |
| Molecular Weight: | 554.58 |
| Molecular Formula: | C27 H26 N2 O9 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2cccc(c2)[N+]([O-])=O)S(C(=C\c2cc(c(c(c2)OC)OC)OC)\C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9908 |
| logD: | 3.9908 |
| logSw: | -4.1897 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 108.02 |
| InChI Key: | XGYVDERMPPTNJG-MHZLTWQESA-N |