N-(4-bromo-2-fluorophenyl)-4-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]butanamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-4-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]butanamide
N-(4-bromo-2-fluorophenyl)-4-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]butanamide
Compound characteristics
Compound ID: | G284-1258 |
Compound Name: | N-(4-bromo-2-fluorophenyl)-4-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]butanamide |
Molecular Weight: | 470.34 |
Molecular Formula: | C22 H21 Br F N5 O |
Smiles: | Cc1cc(C)nc2c1c(nn2CCCC(Nc1ccc(cc1F)[Br])=O)n1cccc1 |
Stereo: | ACHIRAL |
logP: | 4.1756 |
logD: | 4.1275 |
logSw: | -4.3451 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.076 |
InChI Key: | DDLTZHYWOKFBCQ-UHFFFAOYSA-N |