5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-[3-oxo-3-(piperidin-1-yl)propyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-[3-oxo-3-(piperidin-1-yl)propyl]-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-[3-oxo-3-(piperidin-1-yl)propyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3643-0612 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-[3-oxo-3-(piperidin-1-yl)propyl]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C19 H20 N2 O4 S2 |
| Smiles: | C1CCN(CC1)C(CCN1C(/C(=C/c2ccc3c(c2)OCO3)SC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8945 |
| logD: | 2.8945 |
| logSw: | -3.265 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.929 |
| InChI Key: | ZHBCOQASOPPDLN-UHFFFAOYSA-N |