3-benzyl-5-[(4-bromo-3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-benzyl-5-[(4-bromo-3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-benzyl-5-[(4-bromo-3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2476-0047 |
| Compound Name: | 3-benzyl-5-[(4-bromo-3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 435.32 |
| Molecular Formula: | C17 H11 Br N2 O3 S2 |
| Smiles: | C(c1ccccc1)N1C(/C(=C/c2ccc(c(c2)[N+]([O-])=O)[Br])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.925 |
| logD: | 4.925 |
| logSw: | -4.875 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.523 |
| InChI Key: | IYSMXLJBJZZJJI-UHFFFAOYSA-N |