2-氨基烟酰氯化物 | 342614-83-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 中文名称: 2-氨基烟酰氯化物
• 英文名称: 2-Amino-nicotinoyl chloride
• 英文别名: 2-Aminonicotinoyl chloride；2-aminopyridine-3-carbonyl chloride
• CAS: 342614-83-9
• 化学式: C₆H₅ClN₂O
• 分子量: 156.572
• InChiKey: XSBAKONFFCSERK-UHFFFAOYSA-N

物化性质

• 沸点：
  294.2±25.0 °C(Predicted)
• 密度：
  1.406±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  56
• 氢给体数：
  1
• 氢受体数：
  3

安全信息

• 海关编码：
  2933399090

反应信息

• 作为反应物：
  描述：

  2-氨基烟酰氯化物 在 吡啶 、 palladium diacetate 、 potassium carbonate 、 4,5-双二苯基膦-9,9-二甲基氧杂蒽 作用下， 以 四氢呋喃 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 0.12h， 生成 N-(2-chloro-6-methylphenyl)-2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]pyridine-3-carboxamide
  参考文献：
  名称：

  [EN] TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS
  [FR] DÉRIVÉS DE TRIAZINE ET LEURS APPLICATIONS THÉRAPEUTIQUES

  摘要：

  本发明包括如下三唑化合物（如式（I）所示）及其药用可接受盐。

  公开号：

  WO2010144345A1
• 作为产物：
  描述：

  2-氨基烟酸 在 氯化亚砜 作用下， 反应 2.0h， 生成 2-氨基烟酰氯化物
  参考文献：
  名称：

  A CLASS OF ISOINDOLONE-IMIDE RING-1,3-DIONE-2-ENE COMPOUNDS, COMPOSITION AND USE THEREOF

  摘要：

  本发明提供了一种isoindolone-imide环-1,3-二酮-2-烯化合物，以及其制备方法、药物组合物和用途。具体地，本发明提供了下面的式（I）化合物或其药学上可接受的盐，其中Ar是由式（II）表示的isoindolinone-imide基团，L是不存在或是二价、三价或四价的连接基团，X是由式（III）表示的基团。其他基团的定义如规范中所述。式（I）化合物是自噬调节剂，特别是哺乳动物ATG8同源物调节剂。

  公开号：

  US20200071291A1

文献信息

• Synthesis and fungicidal activity of novel pyrroloindole scaffolds and their derivatives
  作者：Wenbin Wu、Qiaoju Jiang、Yi Tan、Yujie Zhou、Jinfeng Chen、Bing Tang、Rui Zhu、Shaojun Zheng

  DOI：10.1039/d2nj01670b

  日期：——

  pyrroloindole ring is a very important structure, which is isolated from plants and fungi with a variety of medical and fungicidal activities. In this paper, a series of pyrroloindole analogues were synthesized from indole-3-acetonitrile and screened for their antifungal activities against plant pathogenic fungi. Compounds a2 and a15 exhibited potent antifungal activities with a minimum inhibitory concentration

  吡咯并吲哚环的关键支架是一种非常重要的结构，它从植物和真菌中分离出来，具有多种医学和杀菌活性。本文以吲哚-3-乙腈为原料合成了一系列吡咯并吲哚类似物，并筛选了它们对植物病原真菌的抗真菌活性。化合物a2和a15对6种真菌表现出强效抗真菌活性，最低抑菌浓度为15.63 μg mL -1，可作为新型抗真菌药物进一步开发。
• Synthesis and Antifungal Activity of Chimonanthus praecox Derivatives
  作者：Jinfeng Chen、Yimou Yang、Yujie Zhou、Yang Wei、Rui Zhu、Shaojun Zheng

  DOI：10.3390/molecules27175570

  日期：——

  To search for efficient agricultural antifungal lead compounds, 39 Chimonanthus praecox derivatives were designed, synthesized, and evaluated for their antifungal activities. The structures of target compounds were fully characterized by 1H NMR, 13C NMR, and MS spectra. The preliminary bioassays revealed that some compounds exhibited excellent antifungal activities in vitro. For example, the minimum inhibitory concentration (MIC) of compound b15 against Phytophthora infestans was 1.95 µg mL−1, and the minimum inhibitory concentration (MIC) of compound b17 against Sclerotinia sclerotiorum was 1.95 µg mL−1. Therefore, compounds b15 and b17 were identified as the most promising candidates for further study.

  为了寻找高效的农业抗真菌铅化合物，设计、合成和评估了39个延龄花衍生物的抗真菌活性。目标化合物的结构通过1H NMR、13C NMR和MS光谱完全表征。初步的生物测定表明，一些化合物在体外表现出优异的抗真菌活性。例如，化合物b15对马铃薯晚疫病菌的最小抑菌浓度（MIC）为1.95 µg mL−1，化合物b17对菜菌菇菌的最小抑菌浓度（MIC）为1.95 µg mL−1。因此，化合物b15和b17被确定为进一步研究的最有前途的候选化合物。
• Synthesis and Structure–Activity Analysis of Novel Potential Antifungal Cyclotryptamine Alkaloid Derivatives
  作者：Yazhou Yang、Yujie Zhou、Qiaoju Jiang、Yi Tan、Wenbin Wu、Ke Han、Rui Zhu、Shaojun Zheng

  DOI：10.3390/molecules28062617

  日期：——

  A total of 39 novel cyclotryptamine alkaloid derivatives were prepared from 2-(1H-indol-3-yl) acetonitrile. The prepared compounds were evaluated against six plant pathogen fungi. Bioassay results revealed that most of the compounds displayed higher in vitro antifungal activities than the positive control. Notably, compound b2 displayed the broadest and most effective activity among the tested cyclotryptamine

  从 2-(1H-indol-3-yl) 乙腈制备了总共 39 种新型环色胺生物碱衍生物。制备的化合物针对六种植物病原体真菌进行了评估。生物测定结果显示，大多数化合物显示出比阳性对照更高的体外抗真菌活性。值得注意的是，化合物 b2 在所测试的环色胺生物碱衍生物中表现出最广泛和最有效的活性，可能是进一步开发为抗真菌剂的新型潜在先导化合物。
• 5,6-dihydro-4H-benzo[b]thieno-[2,3-d]azepine derivatives
  申请人：PULMOCIDE LIMITED

  公开号：US10189863B2

  公开（公告）日：2019-01-29

  There are provided 5,6-dihydro-4H-benzo[b]thieno-[2,3-d]azepine derivatives which are useful in the treatment of respiratory syncytial virus (RSV) infection and for the prevention of disease associated with RSV infection.

  5,6-二氢-4H-苯并[b]噻吩-[2,3-d]氮杂卓衍生物可用于治疗呼吸道合胞病毒（RSV）感染和预防与 RSV 感染相关的疾病。
• Design, Synthesis, and Biological Activity of Novel, Potent, and Selective (Benzoylaminomethyl)thiophene Sulfonamide Inhibitors of c-Jun-N-Terminal Kinase
  作者：Thomas Rückle、Marco Biamonte、Tania Grippi-Vallotton、Steve Arkinstall、Yves Cambet、Montserrat Camps、Christian Chabert、Dennis J. Church、Serge Halazy、Xuliang Jiang、Isabelle Martinou、Anthony Nichols、Wolfgang Sauer、Jean-Pierre Gotteland

  DOI：10.1021/jm031112e

  日期：2004.12.1

  Several lines of evidence support the hypothesis that c-Jun N-terminal kinases (JNKs) play a critical role in a wide range of disease states including cell death (apoptosis)-related and inflammatory disorders (epilepsy, brain, heart and renal ischemia, neurodegenerative diseases, multiple sclerosis, rheumatoid arthritis, and inflammatory bowel syndrome). The screening of a compound collection led to the identification of a 2-(benzoylaminomethyl)thiophene sulfonamide (AS004509, compound I) as a potent and selective JNK inhibitor. Chemistry and structure-activity relationship (SAR) studies performed around this novel kinase-inhibiting motif indicated that the left and central parts of the molecule were instrumental to maintaining potency at the enzyme. Accordingly, we investigated the JNK-inhibiting properties of a number of variants of the right-hand moiety of the molecule, which led to the identification of 2-(benzoylaminomethyl)thiophene sulfonamide benzotriazole (AS600292, compound 50a), the first potent and selective JNK inhibitor of this class which demonstrates a protective action against neuronal cell death induced by growth factor and serum deprivation.