N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide
Chemical Structure Depiction of
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide
Compound characteristics
Compound ID: | F614-0554 |
Compound Name: | N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide |
Molecular Weight: | 465.56 |
Molecular Formula: | C27 H27 N7 O |
Smiles: | CCC(C(Nc1cc(C)nn1c1c2cnn(c3ccc(C)cc3C)c2ncn1)=O)c1ccccc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.7306 |
logD: | 5.7246 |
logSw: | -5.4612 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.44 |
InChI Key: | ZLCVEQRUERTNIS-OAQYLSRUSA-N |