4-nitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
Chemical Structure Depiction of
4-nitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
4-nitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
Compound characteristics
| Compound ID: | 0109-0227 |
| Compound Name: | 4-nitro-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one |
| Molecular Weight: | 315.29 |
| Molecular Formula: | C18 H9 N3 O3 |
| Smiles: | c1ccc2c(c1)nc1c3cccc4c(ccc(C(n12)=O)c34)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7705 |
| logD: | 3.7705 |
| logSw: | -4.5739 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.019 |
| InChI Key: | JLAHLIKOBNNHKO-UHFFFAOYSA-N |