2-{2-ethoxy-4-[3-methyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
Chemical Structure Depiction of
2-{2-ethoxy-4-[3-methyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
2-{2-ethoxy-4-[3-methyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
Compound characteristics
Compound ID: | J081-0948 |
Compound Name: | 2-{2-ethoxy-4-[3-methyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide |
Molecular Weight: | 476.49 |
Molecular Formula: | C23 H24 N8 O4 |
Smiles: | CCOc1cc(ccc1OCC(N)=O)C1CC(Nc2c1c(C)nn2c1ccc2nnc(C)n2n1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | -0.1532 |
logD: | -0.1565 |
logSw: | -1.997 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 119.946 |
InChI Key: | SDHSPBQGGWZWIA-HNNXBMFYSA-N |