4-butoxy-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}benzamide
Chemical Structure Depiction of
4-butoxy-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}benzamide
4-butoxy-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}benzamide
Compound characteristics
| Compound ID: | F614-0510 |
| Compound Name: | 4-butoxy-N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}benzamide |
| Molecular Weight: | 495.58 |
| Molecular Formula: | C28 H29 N7 O2 |
| Smiles: | CCCCOc1ccc(cc1)C(Nc1cc(C)nn1c1c2cnn(c3ccc(C)cc3C)c2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3294 |
| logD: | 6.3215 |
| logSw: | -5.3784 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.858 |
| InChI Key: | PZDSYMBGRWBURO-UHFFFAOYSA-N |