5-nitro-2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
5-nitro-2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
5-nitro-2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8010-2222 |
| Compound Name: | 5-nitro-2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 350.33 |
| Molecular Formula: | C18 H14 N4 O4 |
| Smiles: | Cc1c(c(C)n(C)n1)N1C(c2cccc3cc(cc(C1=O)c23)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4008 |
| logD: | 1.4008 |
| logSw: | -2.5747 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.861 |
| InChI Key: | PTSVWYROZUUAET-UHFFFAOYSA-N |