3-benzyl-5-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-benzyl-5-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-benzyl-5-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2027-0415 |
| Compound Name: | 3-benzyl-5-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 451.32 |
| Molecular Formula: | C17 H11 Br N2 O4 S2 |
| Smiles: | C(c1ccccc1)N1C(/C(=C/c2cc(cc(c2O)[Br])[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0632 |
| logD: | 2.1684 |
| logSw: | -4.697 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.303 |
| InChI Key: | QJEDCWHSEASSRX-UHFFFAOYSA-N |