3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(4-methyl-1,3-thiazol-2-yl)propanamide
Chemical Structure Depiction of
3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(4-methyl-1,3-thiazol-2-yl)propanamide
3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(4-methyl-1,3-thiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | 3643-0632 |
| Compound Name: | 3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(4-methyl-1,3-thiazol-2-yl)propanamide |
| Molecular Weight: | 433.52 |
| Molecular Formula: | C18 H15 N3 O4 S3 |
| Smiles: | Cc1csc(NC(CCN2C(/C(=C/c3ccc4c(c3)OCO4)SC2=S)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3072 |
| logD: | 3.2825 |
| logSw: | -3.5344 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.538 |
| InChI Key: | ISRWEWGMYORLAI-UHFFFAOYSA-N |