Chem
J-GLOBAL ID：201407088160088898   Nikkaji number：J3.234.831I

AZD-5356

カピバセルチブ
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： C21H25ClN6O2
Molecular formula furigana： C21-H25-CL-N6-O2
Molecular weight： 428.920
InChI： InChI=1S/C21H25ClN6O2/c22-15-3-1-14(2-4-15)17(6-12-29)27-20(30)21(23)7-10-28(11-8-21)19-16-5-9-24-18(16)25-13-26-19/h1-5,9,13,17,29H,6-8,10-12,23H2,(H,27,30)(H,24,25,26)/t17-/m0/s1
InChI key： JDUBGYFRJFOXQC-KRWDZBQOSA-N
SMILES： NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1
Systematic name  (3)：
  • N-[(S)-1-(4-クロロフェニル)-3-ヒドロキシプロピル]-4-アミノ-1-(7H-ピロロ[2,3-d]ピリミジン-4-イル)ピペリジン-4-カルボアミド
  • 4-アミノ-N-[(1S)-1-(4-クロロフェニル)-3-ヒドロキシプロピル]-1-{7H-ピロロ[2,3-d]ピリミジン-4-イル}ピペリジン-4-カルボキサミド
  • 4-amino-N-[(1S)-1-(4-chlorophenyl)-3-hydroxypropyl]-1-{7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide
Other name (5)：
  • N-[(S)-1-(4-Chlorophenyl)-3-hydroxypropyl]-4-amino-1-(7H-pyrrolo[2,3-d]pyrimidine-4-yl)piperidine-4-carboxamide
  • AZD-5363
  • AZD-5356
  • カピバセルチブ
  • Capivasertib
CAS registry number： 1143532-39-1
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