3-methyl-1-(5-phenyl-1,2,4-triazin-3-yl)-4-{2-[(prop-2-en-1-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
3-methyl-1-(5-phenyl-1,2,4-triazin-3-yl)-4-{2-[(prop-2-en-1-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
3-methyl-1-(5-phenyl-1,2,4-triazin-3-yl)-4-{2-[(prop-2-en-1-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D361-0912 |
| Compound Name: | 3-methyl-1-(5-phenyl-1,2,4-triazin-3-yl)-4-{2-[(prop-2-en-1-yl)oxy]phenyl}-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 438.49 |
| Molecular Formula: | C25 H22 N6 O2 |
| Smiles: | Cc1c2C(CC(Nc2n(c2nc(cnn2)c2ccccc2)n1)=O)c1ccccc1OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2565 |
| logD: | 4.256 |
| logSw: | -4.2196 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.879 |
| InChI Key: | SOYJCWODKDSULY-IBGZPJMESA-N |