6-bromo-5-nitro-2-(3-nitrophenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
6-bromo-5-nitro-2-(3-nitrophenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
6-bromo-5-nitro-2-(3-nitrophenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8003-3783 |
| Compound Name: | 6-bromo-5-nitro-2-(3-nitrophenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 442.18 |
| Molecular Formula: | C18 H8 Br N3 O6 |
| Smiles: | c1cc(cc(c1)N1C(c2cccc3c(c(cc(C1=O)c23)[N+]([O-])=O)[Br])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5888 |
| logD: | 3.5888 |
| logSw: | -4.338 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.704 |
| InChI Key: | VQFWSVOSKWCRNQ-UHFFFAOYSA-N |