5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 1013-0332 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 279.33 |
| Molecular Formula: | C12 H9 N O3 S2 |
| Smiles: | CN1C(/C(=C\c2ccc3c(c2)OCO3)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3702 |
| logD: | 2.3702 |
| logSw: | -2.915 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 33.595 |
| InChI Key: | BMTLYKHKIJKQDR-UHFFFAOYSA-N |