2-{[4-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-1-(4-methylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[4-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-1-(4-methylpiperazin-1-yl)ethan-1-one
2-{[4-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-1-(4-methylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | G614-0829 |
| Compound Name: | 2-{[4-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-1-(4-methylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C23 H29 N5 O2 |
| Smiles: | CCc1cc(nc2c1c(C)nn2c1ccc(C)cc1)OCC(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0284 |
| logD: | 2.8164 |
| logSw: | -3.2261 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.631 |
| InChI Key: | QKJJCORPHUDDIW-UHFFFAOYSA-N |