2-ethyl-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}butanamide
Chemical Structure Depiction of
2-ethyl-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}butanamide
2-ethyl-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}butanamide
Compound characteristics
| Compound ID: | F614-0289 |
| Compound Name: | 2-ethyl-N-{1-[1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}butanamide |
| Molecular Weight: | 407.45 |
| Molecular Formula: | C21 H22 F N7 O |
| Smiles: | CCC(CC)C(Nc1cc(C)nn1c1c2cnn(c3ccc(cc3)F)c2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.781 |
| logD: | 3.7785 |
| logSw: | -3.6957 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.012 |
| InChI Key: | TXJIISNYMQEGMR-UHFFFAOYSA-N |