4-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)butanamide
Chemical Structure Depiction of
4-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)butanamide
4-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)butanamide
Compound characteristics
| Compound ID: | 5121-1864 |
| Compound Name: | 4-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)butanamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C20 H21 N3 O5 S2 |
| Smiles: | Cc1cc(NC(CCCN2C(/C(=C/c3ccc(c(c3)OC)OC)SC2=S)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.5711 |
| logD: | 2.5364 |
| logSw: | -3.0631 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.626 |
| InChI Key: | JYDHQNFGZOIISP-UHFFFAOYSA-N |