{5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 4578-0384 |
| Compound Name: | {5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 333.38 |
| Molecular Formula: | C15 H11 N O4 S2 |
| Smiles: | C(C(O)=O)N1C(/C(=C/C2COc3ccccc3C=2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8302 |
| logD: | -1.2887 |
| logSw: | -2.2944 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.468 |
| InChI Key: | ADIHARFOHLWBRD-UHFFFAOYSA-N |