5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2151-0016 |
| Compound Name: | 5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 373.24 |
| Molecular Formula: | C12 H9 Br N2 O3 S2 |
| Smiles: | CCN1C(/C(=C/c2ccc(c(c2)[N+]([O-])=O)[Br])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.623 |
| logD: | 3.623 |
| logSw: | -4.0067 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.519 |
| InChI Key: | WPHPNAAUVWAVLZ-UHFFFAOYSA-N |