13-[4-(4-nitrophenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
13-[4-(4-nitrophenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-[4-(4-nitrophenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C240-0046 |
| Compound Name: | 13-[4-(4-nitrophenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C28 H26 N4 O4 |
| Smiles: | C1CN2C(C(C(N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)=O)c3ccccc3C2=O)c2ccccc12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0979 |
| logD: | 4.0979 |
| logSw: | -4.367 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.236 |
| InChI Key: | AHAZYENPBUMNHM-UHFFFAOYSA-N |