1-(3,5-dimethylphenyl)-3-methyl-4-(4-propoxybenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3,5-dimethylphenyl)-3-methyl-4-(4-propoxybenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3,5-dimethylphenyl)-3-methyl-4-(4-propoxybenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-0920 |
| Compound Name: | 1-(3,5-dimethylphenyl)-3-methyl-4-(4-propoxybenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C25 H27 N3 O3 |
| Smiles: | CCCOc1ccc(cc1)C(C1CC(Nc2c1c(C)nn2c1cc(C)cc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.622 |
| logD: | 4.6172 |
| logSw: | -4.2998 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.248 |
| InChI Key: | FGRCWVWEGWZWRH-NRFANRHFSA-N |