1-(4-bromophenyl)-4-(2,5-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(4-bromophenyl)-4-(2,5-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(4-bromophenyl)-4-(2,5-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1167 |
| Compound Name: | 1-(4-bromophenyl)-4-(2,5-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 470.32 |
| Molecular Formula: | C22 H20 Br N3 O4 |
| Smiles: | Cc1c2C(CC(Nc2n(c2ccc(cc2)[Br])n1)=O)C(c1cc(ccc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5387 |
| logD: | 3.5339 |
| logSw: | -3.8968 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.004 |
| InChI Key: | OXJQUIRWWUKBOG-KRWDZBQOSA-N |