1-(4-bromophenyl)-4-(3-methoxy-4-propoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(4-bromophenyl)-4-(3-methoxy-4-propoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(4-bromophenyl)-4-(3-methoxy-4-propoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1204 |
| Compound Name: | 1-(4-bromophenyl)-4-(3-methoxy-4-propoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 498.38 |
| Molecular Formula: | C24 H24 Br N3 O4 |
| Smiles: | CCCOc1ccc(cc1OC)C(C1CC(Nc2c1c(C)nn2c1ccc(cc1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2285 |
| logD: | 4.2236 |
| logSw: | -4.3748 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.965 |
| InChI Key: | HACMLPWSXYLQRF-SFHVURJKSA-N |