N-[(4-butoxyphenyl)methyl]-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide
Chemical Structure Depiction of
N-[(4-butoxyphenyl)methyl]-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide
N-[(4-butoxyphenyl)methyl]-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide
Compound characteristics
| Compound ID: | G740-1338 |
| Compound Name: | N-[(4-butoxyphenyl)methyl]-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C28 H33 N5 O3 |
| Smiles: | CCCCOc1ccc(CNC(C(CC)N2C(c3c(C(C)=N2)nn(c2ccccc2)c3C)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8424 |
| logD: | 4.8424 |
| logSw: | -4.5725 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.563 |
| InChI Key: | WDKYUYDPRASROO-DEOSSOPVSA-N |