2-{5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Chemical Structure Depiction of
2-{5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
2-{5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Compound characteristics
| Compound ID: | 2389-2931 |
| Compound Name: | 2-{5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C13 H10 N2 O5 S2 |
| Smiles: | CC(C(O)=O)N1C(/C(=C/c2ccc(cc2)[N+]([O-])=O)SC1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8757 |
| logD: | -1.0059 |
| logSw: | -2.3927 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.844 |
| InChI Key: | BJZIYMCAAXFDER-ZETCQYMHSA-N |