2-(3-{1-[5-(3-methoxyphenyl)-1,2,4-triazin-3-yl]-3-methyl-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide
Chemical Structure Depiction of
2-(3-{1-[5-(3-methoxyphenyl)-1,2,4-triazin-3-yl]-3-methyl-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide
2-(3-{1-[5-(3-methoxyphenyl)-1,2,4-triazin-3-yl]-3-methyl-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide
Compound characteristics
| Compound ID: | J081-1188 |
| Compound Name: | 2-(3-{1-[5-(3-methoxyphenyl)-1,2,4-triazin-3-yl]-3-methyl-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide |
| Molecular Weight: | 485.5 |
| Molecular Formula: | C25 H23 N7 O4 |
| Smiles: | Cc1c2C(CC(Nc2n(c2nc(cnn2)c2cccc(c2)OC)n1)=O)c1cccc(c1)OCC(N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8167 |
| logD: | 1.8161 |
| logSw: | -2.355 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 118.806 |
| InChI Key: | QXYSKMCGWBUCGY-IBGZPJMESA-N |