4-{2-[(4-methylphenyl)methoxy]phenyl}-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-{2-[(4-methylphenyl)methoxy]phenyl}-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-{2-[(4-methylphenyl)methoxy]phenyl}-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-0467 |
| Compound Name: | 4-{2-[(4-methylphenyl)methoxy]phenyl}-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 465.51 |
| Molecular Formula: | C26 H23 N7 O2 |
| Smiles: | Cc1ccc(COc2ccccc2C2CC(Nc3c2cnn3c2ccc3nnc(C)n3n2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6989 |
| logD: | 3.6987 |
| logSw: | -3.8032 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.723 |
| InChI Key: | PKIAYPCVZKUQHX-FQEVSTJZSA-N |