5-[(2,4-dimethoxy-5-nitrophenyl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(2,4-dimethoxy-5-nitrophenyl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
5-[(2,4-dimethoxy-5-nitrophenyl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 4058-0027 |
| Compound Name: | 5-[(2,4-dimethoxy-5-nitrophenyl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 411.37 |
| Molecular Formula: | C20 H17 N3 O7 |
| Smiles: | Cc1cccc(c1)N1C(C(=C/c2cc(c(cc2OC)OC)[N+]([O-])=O)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7688 |
| logD: | 2.7292 |
| logSw: | -3.342 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.732 |
| InChI Key: | JZFVZEMOBFNPQU-UHFFFAOYSA-N |