3-benzyl-5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-benzyl-5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-benzyl-5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 1674-0078 |
| Compound Name: | 3-benzyl-5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 434.33 |
| Molecular Formula: | C18 H12 Br N O3 S2 |
| Smiles: | C(c1ccccc1)N1C(/C(=C\c2cc3c(cc2[Br])OCO3)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8476 |
| logD: | 4.8476 |
| logSw: | -4.8591 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 33.558 |
| InChI Key: | GMDJNRHUAYGPNT-UHFFFAOYSA-N |