methyl {5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetate
Chemical Structure Depiction of
methyl {5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetate
methyl {5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetate
Compound characteristics
| Compound ID: | 3453-1609 |
| Compound Name: | methyl {5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetate |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C13 H10 N2 O5 S2 |
| Smiles: | COC(CN1C(/C(=C\c2cccc(c2)[N+]([O-])=O)SC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1143 |
| logD: | 2.1143 |
| logSw: | -2.755 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 70.674 |
| InChI Key: | OVCLVHUOSMUFSO-UHFFFAOYSA-N |