1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-0533 |
| Compound Name: | 1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 435.44 |
| Molecular Formula: | C21 H21 N7 O4 |
| Smiles: | Cc1nnc2ccc(nn12)n1c2c(cn1)C(CC(N2)=O)c1cc(c(c(c1)OC)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2632 |
| logD: | 1.263 |
| logSw: | -2.1083 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.387 |
| InChI Key: | DIOCKKWOCAEQLU-ZDUSSCGKSA-N |