Chem
J-GLOBAL ID：201007079518393894   Nikkaji number：J2.871.816K

PF-4800567

3-[(3-クロロフェノキシ)メチル]-1-(オキサン-4-イル)-1H-ピラゾロ[3,4-d]ピリミジン-4-アミン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C17H18ClN5O2
Molecular formula furigana： C17-H18-CL-N5-O2
Molecular weight： 359.810
InChI： InChI=1S/C17H18ClN5O2/c18-11-2-1-3-13(8-11)25-9-14-15-16(19)20-10-21-17(15)23(22-14)12-4-6-24-7-5-12/h1-3,8,10,12H,4-7,9H2,(H2,19,20,21)
InChI key： AUMDBEHGJRZSOO-UHFFFAOYSA-N
SMILES： Nc1ncnc2n(nc(COc3cccc(Cl)c3)c12)C1CCOCC1
Systematic name  (3)：
  • 3-[(3-クロロフェノキシ)メチル]-1-(テトラヒドロ-2H-ピラン-4-イル)-1H-ピラゾロ[3,4-d]ピリミジン-4-アミン
  • 3-[(3-クロロフェノキシ)メチル]-1-(オキサン-4-イル)-1H-ピラゾロ[3,4-d]ピリミジン-4-アミン
  • 3-[(3-chlorophenoxy)methyl]-1-(oxan-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Other name (2)：
  • 3-[(3-Chlorophenoxy)methyl]-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidine-4-amine
  • PF-4800567
CAS registry number： 1188296-52-7
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