N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-(trifluoromethyl)benzamide
N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-(trifluoromethyl)benzamide
Compound characteristics
Compound ID: | F614-0335 |
Compound Name: | N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-(trifluoromethyl)benzamide |
Molecular Weight: | 481.41 |
Molecular Formula: | C23 H15 F4 N7 O |
Smiles: | Cc1cc(NC(c2ccc(cc2)C(F)(F)F)=O)n(c2c3cnn(c4ccc(cc4)F)c3ncn2)n1 |
Stereo: | ACHIRAL |
logP: | 4.6989 |
logD: | 4.6798 |
logSw: | -4.3961 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.741 |
InChI Key: | ODZXXRSSXUPOKE-UHFFFAOYSA-N |