(2-chloro-N-[6-(2-chloroacetylamino)hexyl]acetamide) | 5898-87-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: (2-chloro-N-[6-(2-chloroacetylamino)hexyl]acetamide)
• 英文别名: 2-Chloro-N-[6-(2-chloroacetamido)hexyl]acetamide；2-chloro-N-[6-[(2-chloroacetyl)amino]hexyl]acetamide
• CAS: 5898-87-3
• 化学式: C₁₀H₁₈Cl₂N₂O₂
• mdl: MFCD00186745
• 分子量: 269.171
• InChiKey: JNDOUKGVUWNJGK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  16
• 可旋转键数：
  9
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  58.2
• 氢给体数：
  2
• 氢受体数：
  2

安全信息

• 海关编码：
  2924199090

反应信息

• 作为反应物：
  描述：

  (2-chloro-N-[6-(2-chloroacetylamino)hexyl]acetamide) 在 sodium iodide 作用下， 以 N,N-二甲基甲酰胺 、 丙酮 为溶剂， 反应 18.0h， 生成 2,2'-(3,10-diaza-2,11-dioxododecamethylene)bis(5H-benzo[f]pyrido[4,3-b]indol-2-inium) diiodide
  参考文献：
  名称：

  Synthesis and DNA Binding Properties of γ-Carbolinium Derivatives and Benzologues

  摘要：

  The 5H-pyrido[4,3-b]indole, 11H-indolo[3,2-c]quinoline, 5H-benzo[f]pyrido[4,3-b]indole, and 13H-benz[5,6]indolo[3,2-c]quinoline heteroaromatic nuclei have been synthesized by the Graebe-Ullmann method by classical heating or under microwave irradiation. These tri-, tetra-, and pentacyclic compounds were transformed into the corresponding cationic derivatives by N-alkylation, and the DNA-binding properties of the resulting cationic systems were examined using UV-vis spectroscopy, viscometric determinations, and molecular modeling techniques. The tetracyclic cations were transformed into his-salts by means of a diethyl bispiperidine rigid chain and a more flexible polyamide linker, but the low solubility of these bis-salts made the study of their bisintercalating properties difficult.

  DOI：

  10.1021/jo960266h
• 作为产物：
  描述：

  1,6-己二胺 、 氯乙酸甲酯 以 甲醇 为溶剂， 反应 10.0h， 生成 (2-chloro-N-[6-(2-chloroacetylamino)hexyl]acetamide)
  参考文献：
  名称：

  Bivalent Organophosphorus Compounds—Synthesis and Acetylcholinesterase Inhibitory Activity

  摘要：

  A series of novel symmetric S,S-2,2-(ethane-1,2-diylbis(azanediyl)) bis(2-oxoethane-2,1-diyl) O,O,O,O-tetraethyl diphosphorodithioate derivatives (12) was designed and synthesized based on the cluster effect and the multiple binding sites of acetylcholinesterase (AChE). The structures of all the newly synthesized title compounds were characterized by H-1 and C-13 NMR as well as elemental analyses. Their inhibitory activities against AChE were tested, and compound 12b exhibited the best activity (6.60-fold higher than ethion). The results suggested that the compound would bind to the catalytic center and the narrow gorge of the AChE simultaneously. Supplementary materials are available for this article. Go to the publisher's online edition of Phosphorus, Sulfer, and Silicon and the Related Elements for the following free supplemental files: Additional table.

  DOI：

  10.1080/10426507.2012.736097

文献信息

• AMINO ACID DERIVATIVES AND ABSORBABLE POLYMERS THEREFROM
  申请人：Bezwada Biomedical, LLC

  公开号：US20160257643A1

  公开（公告）日：2016-09-08

  The present invention relates to the discovery of new class of hydrolysable amino acid derivatives and absorbable polyester amides, polyamides, polyepoxides, polyureas and polyurethanes prepared therefrom. The resultant absorbable polymers are useful for drug delivery, tissue engineering, tissue adhesives, adhesion prevention, bone wax formulations, medical device coatings, stents, stent coatings, highly porous foams, reticulated foams, wound care, cardiovascular applications, orthopedic devices, surface modifying agents and other implantable medical devices. In addition, these absorbable polymers should have a controlled degradation profile.

  本发明涉及发现一类新的可水解氨基酸衍生物和可吸收聚酯酰胺、聚酰胺、聚环氧化物、聚脲和由此制备的聚氨酯。由此产生的可吸收聚合物可用于药物输送、组织工程、组织粘合剂、粘附防止、骨蜡配方、医疗器械涂层、支架、支架涂层、高度多孔泡沫、网状泡沫、伤口护理、心血管应用、骨科器械、表面改性剂和其他可植入医疗器械。此外，这些可吸收聚合物应具有受控的降解特性。
• Facile esterification of carboxylic acid using amide functionalized benzimidazolium dicationic ionic liquids
  作者：Prashant Narayan Muskawar、K. Thenmozhi、Jayant M. Gajbhiye、Pundlik Rambhau Bhagat

  DOI：10.1016/j.apcata.2014.06.004

  日期：2014.7

  of carboxylic acids with alkyl/allyl/aryl halides in presence of triethylamine. The amide groups present in this new series of DBimILs are expected to form hydrogen bonding with the carboxylic acids and this could facilitate the esterification reactions under mild conditions devoid of any added catalyst or organic solvent. The plausible mechanism for the enhanced catalytic activity in presence of this

  在这里，我们报告了一系列新的酰胺官能化的基于苯并咪唑鎓的离子型离子液体（DBimILs）的合成，并评估了它们在三乙胺存在下对羧酸与烷基/烯丙基/芳基卤化物的感知酯化的功效。新系列DBimIL中存在的酰胺基有望与羧酸形成氢键，这可以在温和条件下促进酯化反应，而无需添加任何催化剂或有机溶剂。已经提出了在这种新的IL系列存在下增强催化活性的合理机制。从该反应中分离出的相应的烷基/烯丙基/芳基酯在简单萃取后具有高纯度，这消除了进一步纯化的必要性。
• Synthesis and characterisation of bis-cyclen based dinuclear lanthanide complexes
  作者：Thorfinnur Gunnlaugsson、Andrew J. Harte

  DOI：10.1039/b514106k

  日期：——

  The design and synthesis of several bis-macrocyclic cyclen (1,4,7,10-tetraazacyclododecane) ligands and their corresponding lanthanum or europium complexes is described; these dinuclear lanthanide systems were made by connecting two macrocyclic cyclen moieties through a rigid, covalent, p-xylylenediamide bridge or a flexible aliphatic hexane bridge. These ligands were subsequently functionalised with six acetamide pendant arms (CONR1R2: R1 = R2 = H or CH3, or R1 = H, R2 = CH3). The corresponding lanthanide bis-complexes were then formed by reaction with La(III) and Eu(III) triflates, yielding overall cationic (+VI charged) complexes.

  本文描述了几种双大环环丙烷（1,4,7,10-四氮杂环十二烷）配体及其相应的镧或铕配合物的设计和合成；这些双核稀土金属体系是通过刚性的共价对二甲苯二胺桥或灵活的脂肪族己烷桥连接两个大环环丙烷部分而成。随后，这些配体通过六个乙酰胺侧链（CONR1R2: R1 = R2 = H 或 CH3，或 R1 = H，R2 = CH3）进行了功能化。然后，通过与La(III)和Eu(III)三氟甲基磺酸盐的反应形成相应的稀土双配合物，最终得到带正电 (+VI 价) 的配合物。
• A fluorescent sensor for thymine based on bis-BODIPY containing butanediamido bridges
  作者：Jiahui Bi、Xiaoyu Ji、Meiyan Guo、Hongyu Guo、Fafu Yang

  DOI：10.1039/c9nj00406h

  日期：——

  analysis of deoxyribonucleic acid in living organisms. In this work, a series of bis-BODIPY derivatives, namely, 3a–3c with diamido bridges were designed and prepared in yields of 74–77% through a simple procedure. The sensing abilities of compounds 3a–3c for adenine, guanine, cytosine, thymine, glucose, urea and haemoglobin were examined by UV-vis and fluorescence spectra. Sample 3b was demonstrated

  胸腺嘧啶检测传感器在活生物体中脱氧核糖核酸的分析中具有重要意义。在这项工作中，设计并制备了一系列的双-BODIPY衍生物，即带有二氨基桥的3a-3c，并通过简单的方法制备，产率为74-77％。通过紫外可见光谱和荧光光谱检查了化合物3a-3c对腺嘌呤，鸟嘌呤，胞嘧啶，胸腺嘧啶，葡萄糖，尿素和血红蛋白的感测能力。在所有其他测试物种中，样品3b被证明是对胸腺嘧啶的良好选择性传感器。样品3b的检出限低至1.53×10 -6M代表胸腺嘧啶。竞争性实验表明，其他物种对胸腺嘧啶的选择性传感器略有影响。FT-IR，1 H NMR和MS光谱证实了拟议的传感机制。在活细胞成像中，样品3b表现出良好的生物成像性能，并具有亮绿色荧光。添加胸腺嘧啶后显着的荧光猝灭现象暗示了样品3b对活细胞中胸腺嘧啶的感测能力。
• A “turn-on” fluorescent sensor for cytosine in aqueous media based on diamino-bridged biphenyl acrylonitrile
  作者：Jiaojiao Chen、Bangyi Zhou、Yongsheng Li、Linlu Zheng、Hongyu Guo、Fafu Yang

  DOI：10.1039/d0nj05098a

  日期：——

  A “turn-on” fluorescent sensor for cytosine in aqueous media was prepared.

  在水介质中制备了一种用于检测胞嘧啶的“开启”荧光传感器。