Ly-2584702
4-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[5,4-d]pyrimidine
Molecular Identity
Ly-2584702
4-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[5,4-d]pyrimidine
PubChem CID: 25118925
2D Structure
Properties
C21H19F4N7
Molecular Formula
445.40
Molecular Weight
g/mol
445.1638
Exact Mass
Da
3.6
XLogP
Drug-like (Lipinski: < 5)
75.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
9
H-Bond Acceptors
644
Complexity
SMILES
Canonical SMILES
SMILES: CN1C=C(N=C1C2CCN(CC2)C3=NC=NC4=C3C=NN4)C5=CC(=C(C=C5)F)C(F)(F)FIsomeric SMILES
SMILES: CN1C=C(N=C1C2CCN(CC2)C3=NC=NC4=C3C=NN4)C5=CC(=C(C=C5)F)C(F)(F)FSynonyms(20)
1082949-67-4LY2584702LY-2584702LY 25847024-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[3,4-d]pyrimidineI4965C6W4O1H-Pyrazolo(3,4-d)pyrimidine, 4-(4-(4-(4-fluoro-3-(trifluoromethyl)phenyl)-1-methyl-1H-imidazol-2-yl)-1-piperidinyl)-4-(4-(4-(4-fluoro-3-(trifluoromethyl)phenyl)-1-methylimidazol-2-yl)piperidin-1-yl)-1H-pyrazolo(3,4-d)pyrimidineRefChem:154540p70S6K Inhibitor LY25847024-(4-(4-fluoro-3-(trifluoromethyl)phenyl)-1-methyl-1H-imidazol-2-yl)-1-(1H-pyrazolo(3,4-d)pyrimidin-4-yl)piperidineLY-2584702 free baseUNII-I4965C6W4OLY-2584702 (free base)4-(4-(4-(4-Fluoro-3-(trifluoromethyl)phenyl)-1-methyl-1H-imidazol-2-yl)piperidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
Data from PubChem (NCBI)
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