4-甲基-N-[4-[(4-甲基-1-哌嗪基)甲基]-3-(三氟甲基)苯基]-3-[2-(1H-吡唑并[3,4-b]吡啶-5-基)乙炔基]苯甲酰胺

• 常用名: 4-甲基-N-[4-[(4-甲基-1-哌嗪基)甲基]-3-(三氟甲基)苯基]-3-[2-(1H-吡唑并[3,4-b]吡啶-5-基)乙炔基]苯甲酰胺
• 英文名: GZD824
• CAS号: 1257628-77-5
• 分子量: 532.560
• 密度: 1.4±0.1 g/cm3
• 沸点: 630.4±55.0 °C at 760 mmHg
• 分子式: C₂₉H₂₇F₃N₆O
• 熔点: N/A
• 闪点: 335.0±31.5 °C

用途

GZD824是新型口服的Bcr-Abl野生型和T315I突变型抑制剂,IC50分别为0.34和0.68nM。

名称

• 中文名: 4-甲基-N-[4-[(4-甲基-1-哌嗪基)甲基]-3-(三氟甲基)苯基]-3-[2-(1H-吡唑并[3,4-b]吡啶-5-基)乙炔基]苯甲酰胺
• 英文名: 3-(2-(1H-pyrazolo[3,4-b]pyridin-5-yl)ethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide

生物活性

• 描述: GZD824是新型口服的Bcr-Abl野生型和T315I突变型抑制剂,IC50分别为0.34和0.68nM。
• 相关类别:
  信号通路 >> 蛋白酪氨酸激酶 >> BCR-ABL
  研究领域 >> 癌症
• 参考文献:

  [1]. Ren X, Pan X, Zhang Z, Identification of GZD824 as an orally bioavailable inhibitor that targets phosphorylated and nonphosphorylated breakpoint cluster region-Abelson (Bcr-Abl) kinase and overcomes clinically acquired mutation-induced resistance against

物理化学性质

• 密度: 1.4±0.1 g/cm3
• 沸点: 630.4±55.0 °C at 760 mmHg
• 分子式: C₂₉H₂₇F₃N₆O
• 分子量: 532.560
• 闪点: 335.0±31.5 °C
• 精确质量: 532.219849
• PSA: 77.15000
• LogP: 3.93
• 蒸汽压: 0.0±1.8 mmHg at 25°C
• 折射率: 1.667
• 储存条件: -20°C

靶点实验

查看更多实验

实验名称：Primary qHTS assay for small molecule inhibitors of Inositol hexaphosphate kinase 1 (... 来源：NCGC External Id：IP6K1-p1

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

实验名称：Half-life in Sprague-Dawley rat at 25 mg/kg, po 来源：ChEMBL 靶标：N/A External Id：CHEMBL5241435

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

实验名称：Oral bioavailability in Sprague-Dawley rat at 25 mg/kg 来源：ChEMBL 靶标：N/A External Id：CHEMBL5241436

实验名称：Cytotoxicity counterscreen for inhibitors of SARS-CoV-2 cell entry 来源：NCGC 靶标：N/A External Id：TRND-SARS-CoV-2-cytotox-48hr

实验名称：Primary qHTS to identify inhibitors of SARS-CoV-2 cell entry 来源：NCGC External Id：TRND-SARS-CoV-2-PP

实验名称：Primary qHTS for Identification of Calcium Integrin Binding Protein 1 (CIB1) Competit... 来源：NCGC External Id：CIB1-p1-p2

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英文别名

• 4-Methyl-N-{4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)phenyl}-3-(1H-pyrazolo[3,4-b]pyridin-5-ylethynyl)benzamide
• GZD824