2-ethyl-5-nitro-6-(piperidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-ethyl-5-nitro-6-(piperidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-ethyl-5-nitro-6-(piperidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 5386-1272 |
| Compound Name: | 2-ethyl-5-nitro-6-(piperidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 353.38 |
| Molecular Formula: | C19 H19 N3 O4 |
| Smiles: | CCN1C(c2cccc3c(c(cc(C1=O)c23)[N+]([O-])=O)N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.788 |
| logD: | 3.788 |
| logSw: | -4.3099 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.781 |
| InChI Key: | ZFQMEBZUCXMDPS-UHFFFAOYSA-N |