3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-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-(5-methyl-1,2-oxazol-3-yl)propanamide
3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide
Compound characteristics
| Compound ID: | 3643-0629 |
| Compound Name: | 3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide |
| Molecular Weight: | 417.46 |
| Molecular Formula: | C18 H15 N3 O5 S2 |
| Smiles: | Cc1cc(NC(CCN2C(/C(=C/c3ccc4c(c3)OCO4)SC2=S)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.1225 |
| logD: | 3.0499 |
| logSw: | -3.3809 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.481 |
| InChI Key: | UTGVKXZZUHTPGY-UHFFFAOYSA-N |