5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-1838 |
| Compound Name: | 5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-3-(4-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 482.29 |
| Molecular Formula: | C16 H8 Br N3 O6 S2 |
| Smiles: | C(=C1/C(N(C(=S)S1)c1ccc(cc1)[N+]([O-])=O)=O)/c1cc(c(c(c1)[Br])O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1718 |
| logD: | 2.2112 |
| logSw: | -4.37 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.772 |
| InChI Key: | UPSARBUGXDHMJX-UHFFFAOYSA-N |