5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2151-1012 |
| Compound Name: | 5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 403.39 |
| Molecular Formula: | C16 H9 N3 O6 S2 |
| Smiles: | C(=C1/C(N(C(=S)S1)c1ccc(cc1)[N+]([O-])=O)=O)\c1ccc(c(c1)[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.673 |
| logD: | 2.8797 |
| logSw: | -3.7768 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.841 |
| InChI Key: | DKGVKDUTYYCHPA-UHFFFAOYSA-N |