3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(4-phenyl-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-phenyl-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-phenyl-1,3-thiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | 3643-0646 |
| Compound Name: | 3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(4-phenyl-1,3-thiazol-2-yl)propanamide |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C23 H17 N3 O4 S3 |
| Smiles: | C(CN1C(/C(=C/c2ccc3c(c2)OCO3)SC1=S)=O)C(Nc1nc(cs1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1609 |
| logD: | 5.1608 |
| logSw: | -5.3604 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.46 |
| InChI Key: | HRBGXQHLPVUWJC-UHFFFAOYSA-N |