Chem
J-GLOBAL ID：201307021079222259   Nikkaji number：J3.130.251J

APD-668

4-[1-(2-フルオロ-4-メシルフェニル)-1H-ピラゾロ[3,4-d]ピリミジン-4-イルオキシ]ピペリジン-1-カルボン酸イソプロピル
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： C21H24FN5O5S
Molecular formula furigana： C21-H24-F-N5-O5-S
Molecular weight： 477.510
InChI： InChI=1S/C21H24FN5O5S/c1-13(2)31-21(28)26-8-6-14(7-9-26)32-20-16-11-25-27(19(16)23-12-24-20)18-5-4-15(10-17(18)22)33(3,29)30/h4-5,10-14H,6-9H2,1-3H3
InChI key： XTRUQJBVQBUKSQ-UHFFFAOYSA-N
SMILES： CC(C)OC(=O)N1CCC(CC1)Oc1ncnc2n(ncc12)c1ccc(cc1F)S(=O)(=O)C
Systematic name  (3)：
  • 4-[1-(2-フルオロ-4-メシルフェニル)-1H-ピラゾロ[3,4-d]ピリミジン-4-イルオキシ]ピペリジン-1-カルボン酸イソプロピル
  • プロパン-2-イル 4-{[1-(2-フルオロ-4-メタンスルホニルフェニル)-1H-ピラゾロ[3,4-d]ピリミジン-4-イル]オキシ}ピペリジン-1-カルボキシラート
  • propan-2-yl 4-{[1-(2-fluoro-4-methanesulfonylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]oxy}piperidine-1-carboxylate
Other name (2)：
  • 4-[1-(2-Fluoro-4-mesylphenyl)-1H-pyrazolo[3,4-d]pyrimidine-4-yloxy]piperidine-1-carboxylic acid isopropyl ester
  • APD-668
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