6-nitro-2-[(pyridin-3-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
6-nitro-2-[(pyridin-3-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
6-nitro-2-[(pyridin-3-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3952-1059 |
| Compound Name: | 6-nitro-2-[(pyridin-3-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 333.3 |
| Molecular Formula: | C18 H11 N3 O4 |
| Smiles: | C(c1cccnc1)N1C(c2cccc3c(ccc(C1=O)c23)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5996 |
| logD: | 2.5996 |
| logSw: | -3.1927 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.452 |
| InChI Key: | OLWCCEKHQIYEHU-UHFFFAOYSA-N |