5-[(2,5-dimethoxyphenyl)methylidene]-3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Chemical Structure Depiction of
5-[(2,5-dimethoxyphenyl)methylidene]-3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
5-[(2,5-dimethoxyphenyl)methylidene]-3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Compound characteristics
| Compound ID: | K506-0006 |
| Compound Name: | 5-[(2,5-dimethoxyphenyl)methylidene]-3-(4-ethoxyphenyl)-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione |
| Molecular Weight: | 524.55 |
| Molecular Formula: | C26 H24 N2 O8 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2cccc(c2)[N+]([O-])=O)S(C(=C\c2cc(ccc2OC)OC)\C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4791 |
| logD: | 4.4791 |
| logSw: | -4.4814 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 100.216 |
| InChI Key: | PQBRMIHOMSLSIU-SANMLTNESA-N |