5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-cyclohexyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-cyclohexyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-cyclohexyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2027-0274 |
| Compound Name: | 5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-cyclohexyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 426.35 |
| Molecular Formula: | C17 H16 Br N O3 S2 |
| Smiles: | C1CCC(CC1)N1C(/C(=C/c2cc3c(cc2[Br])OCO3)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8984 |
| logD: | 4.8984 |
| logSw: | -4.6546 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 32.779 |
| InChI Key: | RXGDKTBFZJNXTO-UHFFFAOYSA-N |