4-(3-bromo-4-fluorophenyl)-3-methyl-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
4-(3-bromo-4-fluorophenyl)-3-methyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(3-bromo-4-fluorophenyl)-3-methyl-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: | J081-0821 |
| Compound Name: | 4-(3-bromo-4-fluorophenyl)-3-methyl-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: | 442.25 |
| Molecular Formula: | C18 H13 Br F N7 O |
| Smiles: | Cc1c2C(CC(Nc2n(c2ccc3nncn3n2)n1)=O)c1ccc(c(c1)[Br])F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.077 |
| logD: | 2.0758 |
| logSw: | -2.9062 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.636 |
| InChI Key: | PSRQENGHGUVGJP-LLVKDONJSA-N |