{5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 1207-0040 |
| Compound Name: | {5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 293.36 |
| Molecular Formula: | C13 H11 N O3 S2 |
| Smiles: | Cc1cccc(\C=C2/C(N(CC(O)=O)C(=S)S2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.7201 |
| logD: | -1.3989 |
| logSw: | -2.2042 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.098 |
| InChI Key: | DENZGZYPQYLMFP-UHFFFAOYSA-N |