4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-cyanoethyl)-N-phenylbutanamide
Chemical Structure Depiction of
4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-cyanoethyl)-N-phenylbutanamide
4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-cyanoethyl)-N-phenylbutanamide
Compound characteristics
| Compound ID: | 3324-0577 |
| Compound Name: | 4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-cyanoethyl)-N-phenylbutanamide |
| Molecular Weight: | 514.46 |
| Molecular Formula: | C23 H20 Br N3 O2 S2 |
| Smiles: | C(CC(N(CCC#N)c1ccccc1)=O)CN1C(/C(=C/c2cccc(c2)[Br])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4167 |
| logD: | 4.4167 |
| logSw: | -4.321 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 49.258 |
| InChI Key: | DCZWGYICWCAKCF-UHFFFAOYSA-N |