N-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-methylbenzamide
N-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | 2798-0578 |
| Compound Name: | N-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-methylbenzamide |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C19 H14 N2 O4 S2 |
| Smiles: | Cc1ccc(cc1)C(NN1C(/C(=C/c2ccc3c(c2)OCO3)SC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4968 |
| logD: | 3.4653 |
| logSw: | -3.7613 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.959 |
| InChI Key: | QJUMHOSXTRLLCZ-UHFFFAOYSA-N |