5-[(2-chloro-4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(2-chloro-4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione
5-[(2-chloro-4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8004-8531 |
| Compound Name: | 5-[(2-chloro-4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 310.65 |
| Molecular Formula: | C11 H7 Cl N4 O5 |
| Smiles: | C(=C1C(NC(NC1=O)=O)=O)Nc1ccc(cc1[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0953 |
| logD: | -1.8322 |
| logSw: | -2.7558 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.928 |
| InChI Key: | FYBNFMPWUQYVTR-UHFFFAOYSA-N |