2-(4-bromophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-bromophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-(4-bromophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3496-0023 |
| Compound Name: | 2-(4-bromophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 397.18 |
| Molecular Formula: | C18 H9 Br N2 O4 |
| Smiles: | c1cc2C(N(C(c3ccc(c(c1)c23)[N+]([O-])=O)=O)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9882 |
| logD: | 3.9882 |
| logSw: | -4.6879 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.323 |
| InChI Key: | NRAAYCXZHXRJBR-UHFFFAOYSA-N |