Chem
J-GLOBAL ID：201107055358623716   Nikkaji number：J2.971.211E

GDC-0980

アピトリシブ
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： C23H30N8O3S
Molecular formula furigana： C23-H30-N8-O3-S
Molecular weight： 498.610
InChI： InChI=1S/C23H30N8O3S/c1-14-17(13-29-3-5-31(6-4-29)22(33)15(2)32)35-19-18(14)27-20(16-11-25-23(24)26-12-16)28-21(19)30-7-9-34-10-8-30/h11-12,15,32H,3-10,13H2,1-2H3,(H2,24,25,26)/t15-/m0/s1
InChI key： YOVVNQKCSKSHKT-HNNXBMFYSA-N
SMILES： C[C@H](O)C(=O)N1CCN(Cc2sc3c(nc(nc3c2C)c2cnc(N)nc2)N2CCOCC2)CC1
Systematic name  (3)：
  • (2S)-1-[4-[[2-(2-アミノ-5-ピリミジニル)-7-メチル-4-モルホリノチエノ[3,2-d]ピリミジン-6-イル]メチル]ピペラジノ]-2-ヒドロキシ-1-プロパノン
  • 6-[4-[(S)-2-ヒドロキシプロパノイル]ピペラジン-1-イルメチル]-7-メチル-2-(2-アミノピリミジン-5-イル)-4-モルホリノチエノ[3,2-d]ピリミジン
  • (2S)-1-(4-{[2-(2-aminopyrimidin-5-yl)-7-methyl-4-(morpholin-4-yl)thieno[3,2-d]pyrimidin-6-yl]methyl}piperazin-1-yl)-2-hydroxypropan-1-one
Other name (6)：
  • (2S)-1-[4-[[2-(2-Amino-5-pyrimidinyl)-7-methyl-4-morpholinothieno[3,2-d]pyrimidine-6-yl]methyl]piperazino]-2-hydroxy-1-propanone
  • (2S)-1-(4-{[2-(2-アミノピリミジン-5-イル)-7-メチル-4-(モルホリン-4-イル)チエノ[3,2-d]ピリミジン-6-イル]メチル}ピペラジン-1-イル)-2-ヒドロキシプロパン-1-オン
  • 6-[4-[(S)-2-Hydroxypropanoyl]piperazine-1-ylmethyl]-7-methyl-2-(2-aminopyrimidine-5-yl)-4-morpholinothieno[3,2-d]pyrimidine
  • GDC-0980
  • アピトリシブ
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Regulation number (1)：
  • 8-(7)-1696
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