6-methyl-2-(4-propan-2-ylphenyl)-1,3-benzothiazole

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 6-methyl-2-(4-propan-2-ylphenyl)-1,3-benzothiazole
• 英文别名: 2-(4-isopropylphenyl)-6-methylbenzo[d]thiazole；2-(4-Isopropylphenyl)-6-methyl-1,3-benzothiazole
• 化学式: C₁₇H₁₇NS
• 分子量: 267.395
• InChiKey: IEYGRRYCLOGOEJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  41.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  4-硝基甲苯 、 4-异丙基苯甲醇 在 iron(III) chloride 、 碘化铵 、 potassium hydrogencarbonate 、 sulfur 作用下， 以 N-甲基吡咯烷酮 为溶剂， 反应 24.0h， 以72%的产率得到6-methyl-2-(4-propan-2-ylphenyl)-1,3-benzothiazole
  参考文献：
  名称：

  铁促进的三组分2-取代的苯并噻唑的合成，通过硝基芳烃邻位-C-H与元素硫的硫化

  摘要：

  描述了一种由硝基芳烃，醇和硫粉制备2-取代的苯并噻唑的三组分方法。该反应显示出良好的官能团耐受性，以中等至良好的产率提供了杂环产物。在一个罐中就实现了包括硝基还原，C–N缩合和C–S键形成的顺序组装。

  DOI：

  10.1021/acs.joc.8b02619

文献信息

• NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION
  申请人：Buckman Brad

  公开号：US20110152246A1

  公开（公告）日：2011-06-23

  The embodiments provide compounds of the general Formulae I, II, III, IV, or V as well as compositions, including pharmaceutical compositions, comprising a subject compound. The embodiments further provide treatment methods, including methods of treating a hepatitis C virus infection and methods of treating liver fibrosis, the methods generally involving administering to an individual in need thereof an effective amount of a subject compound or composition.

  实施例提供了一般式I、II、III、IV或V的化合物，以及包括药物组合物在内的组合物，其中包括一种主体化合物。实施例还提供了治疗方法，包括治疗丙型肝炎病毒感染的方法和治疗肝纤维化的方法，这些方法通常涉及向需要的个体施用一种主体化合物或组合物的有效量。
• METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY
  申请人：THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

  公开号：US20190290778A1

  公开（公告）日：2019-09-26

  Provided herein, inter alia, are methods and compounds for targeted autophagy.

  本文提供了针对靶向自噬的方法和化合物。
• INHIBITORS OF PAPILLOMA VIRUS
  申请人：Yoakim Christiane

  公开号：US20100041649A1

  公开（公告）日：2010-02-18

  A compound of formula (I) or its enantiomers or diastereoisomers thereof: wherein: A, X, W, R 1 , Y; R 3 ; and R 4 are as defined herein. The compounds of the invention may be used as inhibitors of the papilloma virus E1-E2-DNA complex. The invention further provides a method of treating or preventing human papilloma virus infection.

  化合物(I)的公式或其对映体或二对映异构体：其中：A、X、W、R1、Y；R3；和R4如本文所定义。本发明的化合物可用作乳头瘤病毒E1-E2-DNA复合物的抑制剂。本发明还提供了一种用于治疗或预防人乳头瘤病毒感染的方法。
• Efficient 2-aryl benzothiazole formation from acetophenones, anilines, and elemental sulfur by iodine-catalyzed oxidative C(CO)-C(alkyl) bond cleavage
  作者：Yafeng Liu、Xinglong Yuan、Xin Guo、Xueguo Zhang、Baohua Chen

  DOI：10.1016/j.tet.2018.08.047

  日期：2018.10

  A novel and efficient iodine-catalyzed one-pot reaction of aromatic amines, acetophenones, and elemental sulfur for the synthesis of 2-aryl benzothiazoles is described. The process involves sequential C-S and C-N bond formation followed by C(CO)-C bond cleavage from readily accessible starting materials. A wide range of functional groups is tolerated under oxidant and metal-free condition and moderate to good product yields are obtained. (C) 2018 Elsevier Ltd. All rights reserved.
• LINKED DIIMIDAZOLE ANTIVIRALS
  申请人：Or Yat Sun

  公开号：US20100226882A1

  公开（公告）日：2010-09-09

  The present invention discloses compounds of Formula (I), or pharmaceutically acceptable salts, esters, or prodrugs thereof: which inhibit RNA-containing virus, particularly the hepatitis C virus (HCV). Consequently, the compounds of the present invention interfere with the life cycle of the hepatitis C virus and are also useful as antiviral agents. The present invention further relates to pharmaceutical compositions comprising the aforementioned compounds for administration to a subject suffering from HCV infection. The invention also relates to methods of treating an HCV infection in a subject by administering a pharmaceutical composition comprising the compounds of the present invention.