N-(3-acetylphenyl)-1-(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-1-(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)piperidine-4-carboxamide
N-(3-acetylphenyl)-1-(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E859-0082 |
| Compound Name: | N-(3-acetylphenyl)-1-(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)piperidine-4-carboxamide |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C27 H28 N6 O2 |
| Smiles: | CC(c1cccc(c1)NC(C1CCN(CC1)c1c2c(c(C)nn1)c(C)n(c1ccccc1)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2205 |
| logD: | 3.208 |
| logSw: | -3.6139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.188 |
| InChI Key: | UKZFHMZAEDFQHB-UHFFFAOYSA-N |