{5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 1988-1687 |
| Compound Name: | {5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 324.33 |
| Molecular Formula: | C12 H8 N2 O5 S2 |
| Smiles: | C(C(O)=O)N1C(/C(=C/c2ccccc2[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1 |
| logD: | -2.019 |
| logSw: | -2.1355 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.178 |
| InChI Key: | BNVZBLFDBSZWJL-UHFFFAOYSA-N |