CAS: 304693-64-9; Ethyl 2-(Trifluoromethyl)Pyrimidine-5-Carboxylate

该化合物是一种氟丙酰丙胺衍生物,广泛用作制药和农用化学合成的关键中间体,其三氟甲基组组增强代谢稳定性和亲脂性,使其在药物发现中具有价值,以优化生物利用率;酯功能允许进一步衍生,使多种应用能够用于交叉反应和核生殖替代;该复合体表现出高度纯度和连续反应,支持精确的合成路线;其结构特征有助于生物活性分子的开发,特别是在设计动脉抑制剂和抗微生物剂方面;对于受控制的环境来说,它通常在不成熟的条件下处理,以保持稳定性.

英文名称Ethyl 2-(Trifluoromethyl)Pyrimidine-5-Carboxylate
中文名称2-(三氟甲基)嘧啶-5-甲酸乙酯
IUPAC名称ethyl 2-(trifluoromethyl)pyrimidine-5-carboxylate
其它别名2-(三氟甲基)嘧啶-5-甲酸乙酯; 2-三氟甲基嘧啶-5-甲酸乙酯; Ethyl 2-(Trifluoromethyl)
CAS编号304693-64-9
MFCD编号:MFCD09754048
EINECS号:640-777-9
分子式:C8H7F3N2O2分子量:220.15
产品CID: 1290096
产品分类有机原料→分子砌块→芳杂环类化合物→嘧啶类化合物

相似结构搜索
InChIKey: LRUCUGOOQHJEQP-UHFFFAOYSA-N
InChI=1S/C8H7F3N2O2/c1-2-15-6(14)5-3-12-7(13-4-5)8(9,10)11/h3-4H,2H2,1H3
计算化学: 氢键受体数4.0氢键供体数*可旋转键数2.0

相似化合物

304693-66-1 306960-77-0 2134-38-5

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
安全声明H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body

上下游产品

合成工艺路线路线简述

📜4-羟基-2-(三氟甲基)嘧啶-5-甲酸乙酯置于palladium On Activated Charcoal 草酰氯,氢气,N-乙基异丙基胺体系中,用乙醇,二氯甲烷用作溶剂,化学反应生成2-三氟甲基嘧啶-5-羧酸乙酯
参考文献:Potent,Orally Active Inhibitors Of Lipoprotein-Associated Phospholipase A2: 1-(Biphenylmethylamidoalkyl)-Pyrimidones
标题:Potent,Orally Active Inhibitors Of Lipoprotein-Associated Phospholipase A2: 1-(Biphenylmethylamidoalkyl)-Pyrimidones
摘要:A Series Of 1-(Biphenylmethylamidoalkyl)-Pyrimidones Has Been Designed As Nanomolar Inhibitors Of Recombinant Lipoprotein-Associated Phospholipase A(2) With High Potency In Whole Human Plasma. 5-(Pyrazolylmethyl) Derivative 16 And 5-(Methoxypyrimidinylmethyl) Derivative 27 Demonstrated Excellent Pharmacodynamic Profiles Which Correlated Well With Their Pharmacokinetic Effects. (C) 2001 Elsevier Science Ltd. All Rights Reserved.
Doi:10.1016/s0960-894X(01)00678-3