2-(2-methoxy-4-{3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide
Chemical Structure Depiction of
2-(2-methoxy-4-{3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide
2-(2-methoxy-4-{3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide
Compound characteristics
Compound ID: | D361-0802 |
Compound Name: | 2-(2-methoxy-4-{3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl}phenoxy)acetamide |
Molecular Weight: | 499.53 |
Molecular Formula: | C26 H25 N7 O4 |
Smiles: | Cc1ccc(cc1)c1cnnc(n1)n1c2c(C(CC(N2)=O)c2ccc(c(c2)OC)OCC(N)=O)c(C)n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.052 |
logD: | 2.0515 |
logSw: | -2.8608 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 118.979 |
InChI Key: | KDGXPAGLZLQFNH-SFHVURJKSA-N |