3-{5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-{5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-1lambda~6~-thiolane-1,1-dione
3-{5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | 5756-2543 |
| Compound Name: | 3-{5-[(2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 393.5 |
| Molecular Formula: | C17 H15 N O4 S3 |
| Smiles: | C1CS(CC1N1C(/C(=C/C2COc3ccccc3C=2)SC1=S)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2893 |
| logD: | 2.2893 |
| logSw: | -2.5849 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 52.471 |
| InChI Key: | RLXKGHGRYSGDEF-CYBMUJFWSA-N |