[3,4-二氟-2-[(2-氟-4-碘苯基)氨基]苯基][3-羟基-3-[(2R)-2-哌啶基]-1-氮杂环丁基]甲酮

• 常用名: [3,4-二氟-2-[(2-氟-4-碘苯基)氨基]苯基][3-羟基-3-[(2R)-2-哌啶基]-1-氮杂环丁基]甲酮
• 英文名: Cobimetinib (R-enantiomer)
• CAS号: 934660-94-3
• 分子量: 531.31000
• 密度: N/A
• 沸点: N/A
• 分子式: C₂₁H₂₁F₃IN₃O₂
• 熔点: N/A
• 闪点: N/A

用途

Cobimetinib R-对映体(GDC-0973; XL518)是MEK选择性抑制剂。

名称

• 中文名: [3,4-二氟-2-[(2-氟-4-碘苯基)氨基]苯基][3-羟基-3-[(2R)-2-哌啶基]-1-氮杂环丁基]甲酮
• 英文名: [3,4-difluoro-2-(2-fluoro-4-iodoanilino)phenyl]-[3-hydroxy-3-[(2R)-piperidin-2-yl]azetidin-1-yl]methanone

生物活性

• 描述: Cobimetinib R-enantiomer 是 Cobimetinib 的低活性 R 型对映体。Cobimetinib 是一种有效的选择性 MEK 抑制剂。
• 相关类别:
  研究领域 >> 癌症
• 参考文献:

  [1]. Hoeflich KP, et al. Intermittent administration of MEK inhibitor GDC-0973 plus PI3K inhibitor GDC-0941 triggers robust apoptosis and tumor growth inhibition. Cancer Res. 2012 Jan 1;72(1):210-9.

物理化学性质

• 分子式: C₂₁H₂₁F₃IN₃O₂
• 分子量: 531.31000
• 精确质量: 531.06300
• PSA: 64.60000
• LogP: 4.12080
• InChIKey: BSMCAPRUBJMWDF-QGZVFWFLSA-N
• SMILES: O=C(c1ccc(F)c(F)c1Nc1ccc(I)cc1F)N1CC(O)(C2CCCCN2)C1
• 储存条件: -20°C，密闭，干燥

靶点实验

查看更多实验

实验名称：Primary qHTS for small molecule stabilizers of the endoplasmic reticulum resident pro... 来源：NCGC 靶标：N/A External Id：SERCaMPGLuc-p1-antagonist

实验名称：Primary qHTS assay for inhibitors of alpha-synuclein gene (SNCA) expression 来源：NCGC External Id：SNCA-p-activity-luciferase

实验名称：Confirmatory qHTS assay for small molecule inhibitors of Inositol hexaphosphate kinas... 来源：NCGC External Id：IP6K1-f1-cherrypicks

实验名称：Primary qHTS for Identification of Small Molecule Activators of Huntingtin-Antisense ... 来源：NCGC External Id：huntington-HTTAS8-p1-FF-overN

实验名称：Cytochrome P450 family 3 subfamily A member 4 (CYP3A4) small molecule antagonists: lu... 来源：NCGC External Id：CYP3A4437

实验名称：Cytochrome P450 family 2 subfamily D member 6 (CYP2D6) small molecule antagonists: lu... 来源：NCGC External Id：CYP2D6395

实验名称：qHTS assay for measurement of the activity of small molecule inhibitors on Zika virus... 来源：NCGC 靶标：N/A External Id：ZIK159

实验名称：Cytochrome P450 family 2 subfamily C member 9 (CYP2C9) small molecule antagonists: lu... 来源：NCGC External Id：CYP2C9536

实验名称：qHTS assay for measurement of the activity of small molecule inhibitors on Zika virus... 来源：NCGC 靶标：N/A External Id：ZIK097

实验名称：Quantitative High-Throughput drug screen in 47 multiple myeloma cell lines against th... 来源：NCGC 靶标：N/A External Id：s-my-keats_OPM1-m4-1

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英文别名

• 1-({3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]phenyl}carbonyl)-3-[(2R)-piperidin-2-yl]azetidin-3-ol
• Cobimetinib (R-enantiomer)
• (R)-XL518
• GDC-0973 R-enantiomer
• CS-1022