1-(3-methylphenyl)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(3-methylphenyl)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-diazinane-2,4,6-trione
1-(3-methylphenyl)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3448-1303 |
| Compound Name: | 1-(3-methylphenyl)-5-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 395.33 |
| Molecular Formula: | C19 H13 N3 O7 |
| Smiles: | Cc1cccc(c1)N1C(C(=C\c2cc3c(cc2[N+]([O-])=O)OCO3)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4598 |
| logD: | 2.3507 |
| logSw: | -2.9038 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.587 |
| InChI Key: | FFVWXPGYTIZUCO-UHFFFAOYSA-N |