N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-methylbenzamide
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-methylbenzamide
Compound characteristics
Compound ID: | F614-0126 |
Compound Name: | N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-methylbenzamide |
Molecular Weight: | 443.89 |
Molecular Formula: | C23 H18 Cl N7 O |
Smiles: | Cc1ccc(cc1)C(Nc1cc(C)nn1c1c2cnn(c3ccc(cc3)[Cl])c2ncn1)=O |
Stereo: | ACHIRAL |
logP: | 4.8152 |
logD: | 4.7961 |
logSw: | -4.9033 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.741 |
InChI Key: | PCVMQOZLUPSBRW-UHFFFAOYSA-N |