5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-1920 |
| Compound Name: | 5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one |
| Molecular Weight: | 443.85 |
| Molecular Formula: | C18 H9 Cl F3 N O3 S2 |
| Smiles: | C1Oc2cc(\C=C3/C(N(C(=S)S3)c3cccc(c3)C(F)(F)F)=O)c(cc2O1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.273 |
| logD: | 5.273 |
| logSw: | -6.0054 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 32.946 |
| InChI Key: | KNVWQPGYXKTCNN-UHFFFAOYSA-N |