4-(2,6-dimethoxybenzoyl)-3-methyl-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(2,6-dimethoxybenzoyl)-3-methyl-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(2,6-dimethoxybenzoyl)-3-methyl-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1631 |
| Compound Name: | 4-(2,6-dimethoxybenzoyl)-3-methyl-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 391.43 |
| Molecular Formula: | C22 H21 N3 O4 |
| Smiles: | Cc1c2C(CC(Nc2n(c2ccccc2)n1)=O)C(c1c(cccc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8358 |
| logD: | 1.831 |
| logSw: | -2.2163 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.091 |
| InChI Key: | XVSXUGHSIWFYTK-HNNXBMFYSA-N |