1599432-18-4

中文名称 1599432-18-4

英文名称 Ibrutinib-biotin

CAS 1599432-18-4

分子式 C56H80N12O9S

分子量 1097.37

MOL 文件 1599432-18-4.mol

更新日期 2023/03/20 15:41:23

1599432-18-4 结构式

基本信息物理化学性质常见问题列表

基本信息

中文别名

依鲁替尼生物素
BTK抑制剂(IBRUTINIB-BIOTIN)

英文别名

Ibrutinib-biotin
Ibrutinib-biotin-1
Reaxys ID: 26833452
Pentanediamide, N1-[4-[[4-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-4-oxo-2-buten-1-yl]methylamino]butyl]-N5-[19-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-15-oxo-4,7,10-trioxa-14-azanonadec-1-yl]-

物理化学性质

沸点1288.9±65.0 °C(Predicted)

密度1.33±0.1 g/cm3(Predicted)

储存条件-20°C储存

溶解度DMSO: 50 mg/mL (45.56 mM)

酸度系数(pKa)13.90±0.40(Predicted)

常见问题列表

生物活性

Ibrutinib-biotin 是一种由 Ibrutinib 通过长链接头连接到生物素上组成的探针，具体可参考 WO2014059368A1 中 Compound 1-5，抑制 BTK，IC50 值为 0.755-1.02 nM。

靶点

IC50: 0.755-1.02 nM (BTK), 1.71-2.29 nM (TEC), 3.66-4.27 nM (BLK), 4.42-5.57 nM (BMX), 5.99-6.92 nM (LCK), 33.8-36.3 nM (Src), 0.187-0.198 μM (ITK),5.34-4.87 μM (JAK3)

体外研究

Ibrutinib-biotin (Compound 1-5) is a probe that consists of Ibrutinib linked to biotin via a long chain linker. Ibrutinib is a TEC family kinase inhibitor. The TEC kinase family is composed of five members, TEC, BTK (Bruton's Tyrosine Kinase), ITK (interleukin-2-inducible T-cell kinase)/EMT/TSK, BMX and TXK/RLK. The TEC family kinases participate in phosphotyrosine- mediated and phospholipid-mediated signaling systems. Many TEC family proteins are abundantly expressed in hematopoietic tissues, and play important roles in the growth and differentiation processes of blood cells.