N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-[4-(propan-2-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-[4-(propan-2-yl)phenoxy]acetamide
N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-[4-(propan-2-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | F614-0446 |
| Compound Name: | N-{1-[1-(2,3-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-[4-(propan-2-yl)phenoxy]acetamide |
| Molecular Weight: | 495.58 |
| Molecular Formula: | C28 H29 N7 O2 |
| Smiles: | CC(C)c1ccc(cc1)OCC(Nc1cc(C)nn1c1c2cnn(c3cccc(C)c3C)c2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8965 |
| logD: | 5.8946 |
| logSw: | -5.5623 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.726 |
| InChI Key: | RNPBXZXIQMEZAD-UHFFFAOYSA-N |