4-{5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid
Chemical Structure Depiction of
4-{5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid
4-{5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid
Compound characteristics
| Compound ID: | 1503-1414 |
| Compound Name: | 4-{5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzoic acid |
| Molecular Weight: | 386.4 |
| Molecular Formula: | C17 H10 N2 O5 S2 |
| Smiles: | C(=C1/C(N(C(=S)S1)c1ccc(cc1)C(O)=O)=O)\c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6024 |
| logD: | 1.2072 |
| logSw: | -3.7956 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.62 |
| InChI Key: | YGOHAESPIBTEAU-UHFFFAOYSA-N |