2-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
Chemical Structure Depiction of
2-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
2-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
Compound characteristics
| Compound ID: | E854-5284 |
| Compound Name: | 2-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C28 H33 N5 O3 |
| Smiles: | CCC(C(NCc1ccc(cc1)OC(C)C)=O)N1C(c2c(C(C)=N1)c(C)n(c1ccc(C)cc1)n2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6216 |
| logD: | 4.6216 |
| logSw: | -4.4279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.948 |
| InChI Key: | ZDXKLIGZBQETOH-DEOSSOPVSA-N |