N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide
Chemical Structure Depiction of
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide
Compound characteristics
| Compound ID: | F614-0175 |
| Compound Name: | N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-phenylbutanamide |
| Molecular Weight: | 471.95 |
| Molecular Formula: | C25 H22 Cl N7 O |
| Smiles: | CCC(C(Nc1cc(C)nn1c1c2cnn(c3ccc(cc3)[Cl])c2ncn1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2254 |
| logD: | 5.2194 |
| logSw: | -5.7044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.741 |
| InChI Key: | VGHWVSOAKOFLQR-HXUWFJFHSA-N |