3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(1,3-benzothiazol-2-yl)propanamide
Chemical Structure Depiction of
3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(1,3-benzothiazol-2-yl)propanamide
3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(1,3-benzothiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | 3643-0678 |
| Compound Name: | 3-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(1,3-benzothiazol-2-yl)propanamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C21 H15 N3 O4 S3 |
| Smiles: | C(CN1C(/C(=C/c2ccc3c(c2)OCO3)SC1=S)=O)C(Nc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5179 |
| logD: | 4.5177 |
| logSw: | -4.3835 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.447 |
| InChI Key: | FARPJYUVSMIAAQ-UHFFFAOYSA-N |