methyl 1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
methyl 1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
Compound characteristics
| Compound ID: | Y503-4152 |
| Compound Name: | methyl 1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylate |
| Molecular Weight: | 457.41 |
| Molecular Formula: | C22 H18 F3 N5 O3 |
| Smiles: | Cc1cc(C(=O)OC)c2c(C)nn(c3nc(cc(C(F)(F)F)n3)c3ccc(cc3)OC)c2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8434 |
| logD: | 4.8431 |
| logSw: | -4.9167 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.385 |
| InChI Key: | PQKXSDSBNGHCTI-UHFFFAOYSA-N |