1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-{4-[(propan-2-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-{4-[(propan-2-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-{4-[(propan-2-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-0537 |
| Compound Name: | 1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-{4-[(propan-2-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C21 H21 N7 O2 |
| Smiles: | CC(C)Oc1ccc(cc1)C1CC(Nc2c1cnn2c1ccc2nnc(C)n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1632 |
| logD: | 2.1629 |
| logSw: | -2.7189 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.212 |
| InChI Key: | OQXZOGDAEQUDFT-INIZCTEOSA-N |