5-[(2-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(2-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
5-[(2-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8006-9214 |
| Compound Name: | 5-[(2-hydroxy-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 305.24 |
| Molecular Formula: | C13 H11 N3 O6 |
| Smiles: | CN1C(C(=Cc2cc(ccc2O)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3872 |
| logD: | -0.8383 |
| logSw: | -1.8803 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.055 |
| InChI Key: | XRZUNITVDJCPHZ-UHFFFAOYSA-N |