3-methyl-4-[4-(propan-2-yl)phenyl]-1-([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
3-methyl-4-[4-(propan-2-yl)phenyl]-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
3-methyl-4-[4-(propan-2-yl)phenyl]-1-([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: | J081-0853 |
| Compound Name: | 3-methyl-4-[4-(propan-2-yl)phenyl]-1-([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: | 387.44 |
| Molecular Formula: | C21 H21 N7 O |
| Smiles: | CC(C)c1ccc(cc1)C1CC(Nc2c1c(C)nn2c1ccc2nncn2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.738 |
| logD: | 2.7367 |
| logSw: | -3.0635 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.636 |
| InChI Key: | WBSOOVZYDMFLIJ-INIZCTEOSA-N |