5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8006-9215 |
| Compound Name: | 5-[(2-hydroxy-3,5-dinitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 350.24 |
| Molecular Formula: | C13 H10 N4 O8 |
| Smiles: | CN1C(C(=Cc2cc(cc(c2O)[N+]([O-])=O)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5027 |
| logD: | -3.7023 |
| logSw: | -1.6396 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 127.067 |
| InChI Key: | MDNONBXNNHWVDE-UHFFFAOYSA-N |