Molecular Design http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD <p><em>Molecular Design</em> (MOLD) <span class="text-dst">mainly serves the molecular design competition (MOLD), which comes from the practical teaching of the course<em> Chemoinformatics</em>. Its predecessor is Journal of Academic Chemists' Start (For Academic Knowledge Exercises), or JACS (FAKE), which was established in 2021.</span></p> 中国人民大学化学系 zh-CN Molecular Design Cover http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD/article/view/235 <p>本期是《分子设计》的第二期</p> Yonglin He Copyright (c) 2023 Molecular Design 2023-09-09 2023-09-09 2 1 Synthesis and potential application of a frog-like ether molecule http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD/article/view/208 <p class="90abstract"><span lang="EN-US">Using the methods of cheminformatics, we have designed an interesting frog-like molecule called "frog ether" and studied its synthesis steps. The molecule has a 1, 3-dioxopentane structure and may have antifungal effects similar to some drug molecules. In addition, ring-opening polymerization based on 1, 3-dioxopentane can form solid electrolytes, which also have potential in the battery energy neighborhood.</span></p> an zhang Yixuan Copyright (c) 2023 Molecular Design 2023-09-09 2023-09-09 2 1 2 4 Research on Molecular Design and Synthesis Methods of "Ant Acid" http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD/article/view/201 <p>Molecular design is a very interesting topic in organic chemistry. Through molecular design methods, we have successfully brought the charmingly naive "ant acid" into reality. The term "ant acid" here does not refer to traditional formic acid molecules, but rather an organic molecule that mimics the form of ants. It has three organic rings as its body, four methyl and two carbonyl groups as its six legs, and two carboxyl groups as its tentacles. The entire molecule is lifelike, reflecting both symmetry and conformational beauty. The main body of "ant acid" is an anthraquinone molecule, which has potential value and application in the pharmaceutical industry.</p> 一 冯 东旭 赵 英东 李 Copyright (c) 2023 Molecular Design 2023-09-09 2023-09-09 2 1 5 8 精灵巯的分子设计和合成方法探究 http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD/article/view/210 <p>有机物“精灵巯”分子由于巯基和硫醚官能团及其桥环化合物的主体结构,理论上具有硫醇和硫醚以及桥环化合物的多重性质,参照硫醇、硫醚和桥环化合物的应用,该分子有着广阔应用前景。本文主要讨论了“精灵巯”的分子设计与合成方法,主要步骤包括羰基与磷叶立德发生的Wittig反应、羟基的溴代反应、醛基与格氏试剂反应等。</p> 杨 赵 佳奕 范 依嘉 浮 Copyright (c) 2023 Molecular Design 2023-09-09 2023-09-09 2 1 9 12 奉先酯的分子设计与合成路线 http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD/article/view/209 <p>聚合物在现代社会里中起着重要作用,如聚己内酯是在生物降解方面已有广泛应用。本文主要讨论小黑酯的分子设计与合成路线,其中的关键步骤有一系列取代反应、Baeyer-Villiger反应制备酯基并实现扩环,及分子内酮基缩合制得五元环。</p> 硕 程 淑炫 张 禹 王 Copyright (c) 2023 Molecular Design 2023-09-09 2023-09-09 2 1 13 16 One step molecular synthesis based on Sonogashira Coupling reaction http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD/article/view/211 <p>Through Sonogashira Coupling reaction, a simple synthesis design of an interesting snowflake like molecule was</p> <p>realized. The molecular synthesis route was simple and efficient, which was a successful practice of organic synthesis by</p> <p>Sonogashira Coupling reaction.</p> 周鸿涛 周 宝灵 马 Copyright (c) 2023 Molecular Design 2023-09-09 2023-09-09 2 1 17 19 Preface http://chemgroups.ruc.edu.cn/VJFE/index.php/MOLD/article/view/236 Yonglin He Copyright (c) 2023 Molecular Design 2023-09-09 2023-09-09 2 1 1 1