2,5-dinitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
Chemical Structure Depiction of
2,5-dinitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
2,5-dinitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
Compound characteristics
| Compound ID: | 0388-0162 |
| Compound Name: | 2,5-dinitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one |
| Molecular Weight: | 360.28 |
| Molecular Formula: | C18 H8 N4 O5 |
| Smiles: | c1ccc2c(c1)nc1c3cc(cc4cc(cc(C(n12)=O)c34)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4399 |
| logD: | 3.4399 |
| logSw: | -4.0555 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 90.702 |
| InChI Key: | RUNCFXWZYYBERT-UHFFFAOYSA-N |