2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-hydroxy-5-nitrophenyl)acetamide
Chemical Structure Depiction of
2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-hydroxy-5-nitrophenyl)acetamide
2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-hydroxy-5-nitrophenyl)acetamide
Compound characteristics
Compound ID: | 3453-0084 |
Compound Name: | 2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(2-hydroxy-5-nitrophenyl)acetamide |
Molecular Weight: | 494.34 |
Molecular Formula: | C18 H12 Br N3 O5 S2 |
Smiles: | C(C(Nc1cc(ccc1O)[N+]([O-])=O)=O)N1C(/C(=C\c2cccc(c2)[Br])SC1=S)=O |
Stereo: | ACHIRAL |
logP: | 3.9924 |
logD: | 3.2735 |
logSw: | -3.8955 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.824 |
InChI Key: | RLFNNKYDXNHKMR-UHFFFAOYSA-N |