CAS: 663619-90-7; 9-Bromo-2-Hydroxy-7-Methylpyrido[1,2-A]Pyrimidin-4-One

该化合物是含有溴,氢氧化和甲基功能组的[1,2a]基质[1,2a]基质核心,其结构框架使它成为有机合成中的宝贵中间体,特别是制药和农用化学应用中的一种.溴的代位可增强通过交叉组合反应进一步功能化的再活动,而氢氧组则有可能衍生或协调化学.甲基组有助于...

英文名称9-Bromo-2-Hydroxy-7-Methylpyrido[1,2-A]Pyrimidin-4-One
中文名称9-溴-2-羟基-7-甲基-4H-吡啶并[1,2-a]嘧啶-4-酮
IUPAC名称9-bromo-2-hydroxy-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
其它别名9-Bromo-2-Hydroxy-7-Methyl-4H-Pyrido[1,2-A]Pyrimidin-4-One; 4H-Pyrido[1,2-A]Pyrimidin-4-One, 9-Bromo-2-Hydroxy-7-Methyl-; 9-Bromo-2-Hydroxy-7-Methyl-4H-Pyrido[1,2-A]Pyrimidin-4-One (Hydrochloride); 9-Bromo-2-Hydroxy-7-Methyl-Pyrido[1,2-A]Pyrimidin-4-One; 9-Bromo-4-Hydroxy-7-Methylpyrido[1,2-A]Pyrimidin-2-One
CAS编号663619-90-7
MFCD编号:MFCD06654830
分子式:C9H7BrN2O2
分子量:255.07
产品CID: 1644942
产品分类有机原料→分子砌块→芳杂环类化合物→吡啶类化合物

相似结构搜索
InChIKey: CIXSBWSXRITMPL-UHFFFAOYSA-N
InChI=1S/C9H7BrN2O2/c1-5-2-6(10)9-11-7(13)3-8(14)12(9)4-5/h2-4,13H,1H3…
计算化学: 氢键受体数4.0氢键供体数1.0可旋转键数0.0

相似化合物

17326-09-9 1173900-34-9 2704433-26-9

MSDS等安全信息

GHS符号GHS07
警示词Warning
危险描述H302-H315-H320-H335
防范说明P261-P280-P302+P352
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

合成目标产物 4H-Pyrido[1,2-A]Pyrimidin-4-One, 9-Bromo-2-Hydroxy-7-Methyl- 主要起始原料 2-Amino-3-Bromo-5-Methylpyridine And Malonyl Chloride
(文献来源)合成步骤主要原料 2-Amino-3-Bromo-5-Methylpyridine 和 Malonyl Chloride

2-氨基-5-甲基吡啶置于溴,Sodium Acetate,溶剂黄146体系中,用丙酮作为反应溶剂,化学反应 2.0H,反应生成 9-溴-2-羟基-7-甲基-4H-吡啶并[1,2-A]嘧啶-4-酮
参考文献:Exploring The Isoform Selectivity Of Tgx-221 Related Pyrido[1,2-A]Pyrimidinone-Based Class Ia Pi 3-Kinase Inhibitors: Synthesis,Biological Evaluation And Molecular Modelling
标题:Exploring The Isoform Selectivity Of Tgx-221 Related Pyrido[1,2-A]Pyrimidinone-Based Class Ia Pi 3-Kinase Inhibitors: Synthesis,Biological Evaluation And Molecular Modelling
摘要:A Novel Series Of Tgx-221 Analogues Was Prepared And Tested For Their Potency Against The P110 Alpha,P110 Beta,And P110 Delta Isoforms Of The Pi3K Enzyme,And In Two Cellular Assays. The Biological Results Were Interpreted In Terms Of A P110 Beta Comparative Model,In Order To Account For Their Selectivity Towards This Isoform. A Ch2Nh Type Linker Is Proposed To Allow Binding Into The Specificity Pocket Proposed To Accommodate The High P110 Beta-Selectivity Of Tgx-221,Although There Was Limited Steric Tolerance For Substituents On The Pendant Ring With The 2-Position Most Favourable For Substitution. (C) 2015 Elsevier Ltd. All Rights Reserved.
DOI:10.1016/j.Bmc.2015.03.073