5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-0416 |
| Compound Name: | 5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 327.81 |
| Molecular Formula: | C13 H10 Cl N O3 S2 |
| Smiles: | CCN1C(/C(=C\c2cc3c(cc2[Cl])OCO3)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5775 |
| logD: | 3.5775 |
| logSw: | -3.82 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 33.554 |
| InChI Key: | HFSTZIBNCNSJIS-UHFFFAOYSA-N |