ChemicalBook CAS数据库列表 (S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one

(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one

CAS号:2375482-51-0
英文名:(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one
中文名:(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one
CBNumber:CB45430811
分子式:C31H28N6O2
分子量:516.59
MOL File:2375482-51-0.mol

(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one化学性质

沸点 :906.5±65.0 °C(Predicted)
密度 :1.41±0.1 g/cm3(Predicted)
储存条件 :Store at -20°C
溶解度 :DMSO:77.5(Max Conc. mg/mL);150.02(Max Conc. mM)
Ethanol:23.0(Max Conc. mg/mL);44.52(Max Conc. mM)
形态 :Solid
酸度系数(pKa) :8.95±0.40(Predicted)
颜色 :Off-white to light yellow

(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one性质、用途与生产工艺

生物活性 BI-2852 是基于药物结构设计的 switch SI/II 口袋的 KRAS 抑制剂，其通过基于结构的药物设计具有纳摩尔亲和力。 BI-2852 在机理上不同于共价 KRASG12C 抑制剂 (结合 switch II)，与活性 KRASG12D 结合强度是与 KRAS wt 的 10 倍 (740 nM vs 7.5 μM)。BI-2852 阻断 GEF，GAP 和效应子与 KRAS 的相互作用，导致下游信号传导的抑制和 KRAS 突变细胞中的抗增殖作用。
靶点

KRAS(G12C)

450 nM (IC ₅₀ )

KRAS(G12C)

750 nM (Kd)
体外研究

BI-2852 (Compound 1) (10 nM-10 µM; 2 hours) shows a dose-dependent pERK modulation and antiproliferative effect at EC ₅₀ s of 5.8 µM and 6.7 µM in soft agar and low serum conditions in NCI-H358 cells.

(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one上下游产品信息

上游原料

下游产品

更新日期：2024/08/19
产品编号：HY-126247
产品名称：(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one BI-2852
CAS编号：2375482-51-0
包装：5 mg
价格：3500元

(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one生产厂家

2375482-51-0, (S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one相关搜索: