5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 1207-0094 |
| Compound Name: | 5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 341.32 |
| Molecular Formula: | C11 H7 N3 O6 S2 |
| Smiles: | CN1C(/C(=C\c2cc(cc(c2O)[N+]([O-])=O)[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4133 |
| logD: | -2.2243 |
| logSw: | -2.3219 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.421 |
| InChI Key: | IZDAIOSNLZTAEN-UHFFFAOYSA-N |