2-(2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)benzoic acid
Chemical Structure Depiction of
2-(2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)benzoic acid
2-(2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)benzoic acid
Compound characteristics
| Compound ID: | 3453-0087 |
| Compound Name: | 2-(2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)benzoic acid |
| Molecular Weight: | 477.35 |
| Molecular Formula: | C19 H13 Br N2 O4 S2 |
| Smiles: | C(C(Nc1ccccc1C(O)=O)=O)N1C(/C(=C\c2cccc(c2)[Br])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5838 |
| logD: | 0.1709 |
| logSw: | -4.291 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.302 |
| InChI Key: | NVTHDMPRIBKWLW-UHFFFAOYSA-N |