5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione
5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8008-4485 |
| Compound Name: | 5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 356.09 |
| Molecular Formula: | C11 H6 Br N3 O6 |
| Smiles: | C(=C1C(NC(NC1=O)=O)=O)c1cc(c(c(c1)[Br])O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.1832 |
| logD: | -0.7774 |
| logSw: | -2.3499 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.203 |
| InChI Key: | UIQBKFLYTAMCRF-UHFFFAOYSA-N |