methyl 4-[3-methyl-6-(pyridin-4-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoate
Chemical Structure Depiction of
methyl 4-[3-methyl-6-(pyridin-4-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoate
methyl 4-[3-methyl-6-(pyridin-4-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoate
Compound characteristics
| Compound ID: | 8018-7858 |
| Compound Name: | methyl 4-[3-methyl-6-(pyridin-4-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoate |
| Molecular Weight: | 412.37 |
| Molecular Formula: | C21 H15 F3 N4 O2 |
| Smiles: | Cc1c2c(cc(c3ccncc3)nc2n(c2ccc(cc2)C(=O)OC)n1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.6118 |
| logD: | 4.6108 |
| logSw: | -4.5526 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.965 |
| InChI Key: | PAJURTPXLYXABC-UHFFFAOYSA-N |