2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-N,N-diethylacetamide
Chemical Structure Depiction of
2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-N,N-diethylacetamide
2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-N,N-diethylacetamide
Compound characteristics
Compound ID: | G219-4100 |
Compound Name: | 2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}-N,N-diethylacetamide |
Molecular Weight: | 454.88 |
Molecular Formula: | C21 H22 Cl F3 N4 O2 |
Smiles: | CCN(CC)C(COc1cc(c2c(C)nn(c3cccc(c3C)[Cl])c2n1)C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 4.8013 |
logD: | 4.8013 |
logSw: | -4.9011 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 46.137 |
InChI Key: | NUIRKNRGXQBJNT-UHFFFAOYSA-N |