methyl 2-(2-{[3-methyl-1-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{[3-methyl-1-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamido)benzoate
methyl 2-(2-{[3-methyl-1-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamido)benzoate
Compound characteristics
| Compound ID: | G219-3805 |
| Compound Name: | methyl 2-(2-{[3-methyl-1-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamido)benzoate |
| Molecular Weight: | 498.46 |
| Molecular Formula: | C25 H21 F3 N4 O4 |
| Smiles: | Cc1ccc(cc1)n1c2c(c(cc(n2)OCC(Nc2ccccc2C(=O)OC)=O)C(F)(F)F)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2085 |
| logD: | 5.1929 |
| logSw: | -5.1597 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.387 |
| InChI Key: | ALQRYRPMJKTRPD-UHFFFAOYSA-N |