Molecules/3,3,3-trifluoro-N-(4-((3-((2S)-2-methylmorpholin-4-yl)-1H-pyrazolo(3,4-d)pyrimidin-6-yl)amino)cyclohexyl)propane-1-sulfonamide
3,3,3-trifluoro-N-(4-((3-((2S)-2-methylmorpholin-4-yl)-1H-pyrazolo(3,4-d)pyrimidin-6-yl)amino)cyclohexyl)propane-1-sulfonamide
3,3,3-trifluoro-N-[4-[[3-[(2S)-2-methylmorpholin-4-yl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]cyclohexyl]propane-1-sulfonamide
Molecular Identity
3,3,3-trifluoro-N-(4-((3-((2S)-2-methylmorpholin-4-yl)-1H-pyrazolo(3,4-d)pyrimidin-6-yl)amino)cyclohexyl)propane-1-sulfonamide
3,3,3-trifluoro-N-[4-[[3-[(2S)-2-methylmorpholin-4-yl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]cyclohexyl]propane-1-sulfonamide
PubChem CID: 122429808
2D Structure
Properties
C19H28F3N7O3S
Molecular Formula
491.50
Molecular Weight
g/mol
491.1926
Exact Mass
Da
2.9
XLogP
Drug-like (Lipinski: < 5)
134
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
12
H-Bond Acceptors
746
Complexity
SMILES
Canonical SMILES
SMILES: CC1CN(CCO1)C2=NNC3=NC(=NC=C32)NC4CCC(CC4)NS(=O)(=O)CCC(F)(F)FIsomeric SMILES
SMILES: C[C@H]1CN(CCO1)C2=NNC3=NC(=NC=C32)NC4CCC(CC4)NS(=O)(=O)CCC(F)(F)FSynonyms(20)
3,3,3-trifluoro-N-(4-((3-((2S)-2-methylmorpholin-4-yl)-1H-pyrazolo(3,4-d)pyrimidin-6-yl)amino)cyclohexyl)propane-1-sulfonamide3,3,3-trifluoro-N-[4-[[3-[(2S)-2-methylmorpholin-4-yl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]cyclohexyl]propane-1-sulfonamideRefChem:144558GSK31868991972617-87-0DDD-853651GSK-3186899DDD853651CHEMBL4563818GSK3186899A1-Propanesulfonamide, 3,3,3-trifluoro-N-[trans-4-[[3-[(2S)-2-methyl-4-morpholinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]cyclohexyl]-3,3,3-trifluoro-N-((1S,4r)-4-((3-((S)-2-methylmorpholino)-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino)cyclohexyl)propane-1-sulfonamide58W44AA6DKorb1308245SCHEMBL17948393
Data from PubChem (NCBI)
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Molecular Structure
3,3,3-trifluoro-N-(4-((3-((2S)-2-methylmorpholin-4-yl)-1H-pyrazolo(3,4-d)pyrimidin-6-yl)amino)cyclohexyl)propane-1-sulfonamide
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Drug Network
Trials and conditions connected to 3,3,3-trifluoro-N-(4-((3-((2S)-2-methylmorpholin-4-yl)-1H-pyrazolo(3,4-d)pyrimidin-6-yl)amino)cyclohexyl)propane-1-sulfonamide
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