1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[(3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl)oxy]ethan-1-one
Chemical Structure Depiction of
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[(3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl)oxy]ethan-1-one
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[(3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl)oxy]ethan-1-one
Compound characteristics
| Compound ID: | G614-0307 |
| Compound Name: | 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[(3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl)oxy]ethan-1-one |
| Molecular Weight: | 499.57 |
| Molecular Formula: | C28 H29 N5 O4 |
| Smiles: | Cc1cc(nc2c1c(C)nn2c1ccccc1)OCC(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4482 |
| logD: | 3.1486 |
| logSw: | -3.8063 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.811 |
| InChI Key: | UEOIUNBKYPYMGC-UHFFFAOYSA-N |