6-(adamantan-1-yl)-4-(difluoromethyl)-1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-1H-pyrazolo[3,4-b]pyridine
Chemical Structure Depiction of
6-(adamantan-1-yl)-4-(difluoromethyl)-1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-1H-pyrazolo[3,4-b]pyridine
6-(adamantan-1-yl)-4-(difluoromethyl)-1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-1H-pyrazolo[3,4-b]pyridine
Compound characteristics
| Compound ID: | Y504-6836 |
| Compound Name: | 6-(adamantan-1-yl)-4-(difluoromethyl)-1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-1H-pyrazolo[3,4-b]pyridine |
| Molecular Weight: | 569.58 |
| Molecular Formula: | C30 H28 F5 N5 O |
| Smiles: | Cc1c2c(cc(C34CC5CC(CC(C5)C4)C3)nc2n(c2nc(cc(C(F)(F)F)n2)c2ccc(cc2)OC)n1)C(F)F |
| Stereo: | ACHIRAL |
| logP: | 8.3942 |
| logD: | 8.3935 |
| logSw: | -6.1323 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.166 |
| InChI Key: | IEQKHXICOGAILP-UHFFFAOYSA-N |