4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-methoxyphenyl)butanamide
Chemical Structure Depiction of
4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-methoxyphenyl)butanamide
4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-methoxyphenyl)butanamide
Compound characteristics
| Compound ID: | 3324-0448 |
| Compound Name: | 4-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-methoxyphenyl)butanamide |
| Molecular Weight: | 491.42 |
| Molecular Formula: | C21 H19 Br N2 O3 S2 |
| Smiles: | COc1ccccc1NC(CCCN1C(/C(=C/c2cccc(c2)[Br])SC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1335 |
| logD: | 4.1335 |
| logSw: | -4.2716 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.503 |
| InChI Key: | VMPJKRQQOGBXTK-UHFFFAOYSA-N |