CAS: 959238-11-0; 4-Chloro-6-Fluoro-2-(Trifluoromethyl)Quinazoline

该化合物是一种合成有机化合物,属于五氯系,其特征为双环结构,含有苯环,并附着于一个火林环.该化合物有几种显著替代成分:四点氯原子,六点氟辛原子,以及五分环两点的三氟甲基组.这些卤素替代成分可显著影响该化合物的化学再活动,稳定性和生物活动.多种氟共聚物的存在往往会增强脂性和代谢稳定性,使这种化合物对药用化学,特别是药品的开发具有兴趣.此外,三氟甲基组所传播的独特电子特性可影响该化合物与生物目标的相互作用.

英文名称4-Chloro-6-Fluoro-2-(Trifluoromethyl)Quinazoline
中文名称4-氯-6-氟-2-(三氟甲基)喹唑啉
IUPAC名称4-chloro-6-fluoro-2-(trifluoromethyl)quinazoline
其它别名Quinazoline, 4-Chloro-6-Fluoro-2-(Trifluoromethyl)-; 4-Chloro-6-Fluoro-2-(Trifluoromethyl)Quinazoline
CAS编号959238-11-0
MFCD编号:MFCD09954902
分子式:C9H3ClF4N2分子量:250.58
产品CID: 2014098
产品分类有机原料→分子砌块→芳杂环类化合物→喹唑啉类化合物

相似结构搜索
InChIKey: RZFQDYUIRJKGOA-UHFFFAOYSA-N
InChI=1S/C9H3ClF4N2/c10-7-5-3-4(11)1-2-6(5)15-8(16-7)9(12,13)14/h1-3H
计算化学: 氢键受体数2.0氢键供体数0可旋转键数0

MSDS等安全信息

GHS符号GHS07
警示词Warning
危险描述H302-H315-H319-H335
防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
危险品标志Xi

合成工艺路线路线简述

63069-49-8 = 959238-11-0
反应条件:1.1 Reagents: Potassium Carbonate Solvents: Dichloromethane; Cooled1.2 Reagents: Potassium Hydroxide Solvents: Acetonitrile; 4 H,80 °C1.3 Reagents: Hydrochloric Acid Solvents: Water; Neutralized1.4 Reagents: Thionyl Chloride Catalysts: Dimethylformamide Solvents: Chloroform; Rt; 6 H,100 °C
标题:Preparation Method Of 2-Trifluoromethyl-4-Aminoquinazoline Compound And Its Application In Preparation Of Antitumor Drug
参考文献:China

📜6-Fluoro-2-Trifluoromethyl-3H-Quinazolin-4-One置于氯化亚砜,N,N-二甲基甲酰胺体系中,用氯仿作为反应溶剂,以82 %的收率获得产物4-氯-6-氟-2-(三氟甲基)喹唑啉
参考文献:Discovery Of Novel N-Aryl-2-Trifluoromethyl-Quinazoline-4-Amine Derivatives As The Inhibitors Of Tubulin Polymerization In Leukemia Cells
标题:Discovery Of Novel N-Aryl-2-Trifluoromethyl-Quinazoline-4-Amine Derivatives As The Inhibitors Of Tubulin Polymerization In Leukemia Cells
摘要:
DOI:10.1016/j.Ejmech.2023.115470