5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8008-7553 |
| Compound Name: | 5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 384.14 |
| Molecular Formula: | C13 H10 Br N3 O6 |
| Smiles: | CN1C(C(=Cc2cc(c(c(c2)[Br])O)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0407 |
| logD: | 0.0801 |
| logSw: | -2.0425 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.685 |
| InChI Key: | SUICYUFSECGKOS-UHFFFAOYSA-N |