3-(2H-1,3-benzodioxol-5-yl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one
3-(2H-1,3-benzodioxol-5-yl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8012-7248 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one |
| Molecular Weight: | 400.41 |
| Molecular Formula: | C19 H16 N2 O6 S |
| Smiles: | COc1cc(/C=C2/C(N(C(=N)S2)c2ccc3c(c2)OCO3)=O)cc(c1O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2978 |
| logD: | 2.2877 |
| logSw: | -2.7995 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.224 |
| InChI Key: | HIWBRHNPKYABSM-UHFFFAOYSA-N |