isopropyl 5'-methyl-5-isobutyl-2,2'-bisthiazole-4-carboxylate | 960527-34-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: isopropyl 5'-methyl-5-isobutyl-2,2'-bisthiazole-4-carboxylate
• 英文别名: Isopropyl 5-isobutyl-5'-methyl-2,2'-bithiazole-4-carboxylate；propan-2-yl 5-(2-methylpropyl)-2-(5-methyl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxylate
• CAS: 960527-34-8
• 化学式: C₁₅H₂₀N₂O₂S₂
• 分子量: 324.468
• InChiKey: VGKYUUXYIVYQBQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  21
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  109
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  Propan-2-yl 2-(5-bromo-1,3-thiazol-2-yl)-5-(2-methylpropyl)-1,3-thiazole-4-carboxylate 、 碘甲烷 在 bis(triphenylphosphine)nickel(II) chloride 锌 作用下， 以 异丁酰胺 为溶剂， 反应 3.0h， 生成 isopropyl 5'-methyl-5-isobutyl-2,2'-bisthiazole-4-carboxylate
  参考文献：
  名称：

  THIAZOLE NON-NUCLEOSIDE COMPOUNDS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITION AND THEIR USE AS ANTIVIRAL AGENTS

  摘要：

  公开号：

  EP2030974B1

文献信息

• 2',2-DITHIAZOL NON-NUCLEOSIDE COMPOUNDS, PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS AND USES AS HEPATITIS VIRUS INHIBITORS THEREOF
  申请人：Nan Fajun

  公开号：US20130059895A1

  公开（公告）日：2013-03-07

  The present disclosure belongs to the field of pharmaceutical chemistry, and relates to a class of 2′,2-bisthiazole non-nucleoside compounds of following formula I, the preparation method and the pharmaceutical composition thereof. The compounds have both the anti-HBV and anti-HCV activities and are useful in treating hepatitides B and C. Pharmacokinetic tests showed the compounds have good bioavailability.

  本公开涉及制药化学领域，涉及以下式I的2'，2-双噻唑非核苷类化合物的一类，其制备方法和制药组合物。该化合物具有抗乙型和丙型肝炎活性，可用于治疗乙型和丙型肝炎。药代动力学测试表明，该化合物具有良好的生物利用度。
• HETEROCYCLIC NON-NUCLEOSIDE COMPOUNDS, THEIR PEPARATION, PHARMACEUTICAL COMPOSITION AND THEIR USE AS ANTIVIRAL AGENTS
  申请人：Shanghai Institute of Materia Medica, Chinese Academy of Sciences

  公开号：EP2030974A1

  公开（公告）日：2009-03-04

  The invention relates a kind of antiviral agents, more concretely, relates to a kind of heterocyclic non-nucleoside compounds with the following structures, their preparation and pharmaceutical compositions including the compounds. The said compounds can be used as antiviral agents and as medicaments for treating diseases such as hepatitis B, influenza, herpes, HIV and so on.

  本发明涉及一种抗病毒剂，更具体地，涉及一种具有以下结构的杂环非核苷类化合物，以及它们的制备和包括这些化合物的药物组合物。所述化合物可用作抗病毒剂，以及用于治疗乙型肝炎、流感、疱疹、人类免疫缺陷病毒等疾病的药物。
• [EN] 2',2-DITHIAZOL NON-NUCLEOSIDE COMPOUNDS, PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS AND USES AS HEPATITIS VIRUS INHIBITORS THEREOF<br/>[FR] COMPOSÉS NON NUCLÉOSIDIQUES DE 2',2-DITHIAZOLE, LEURS PROCÉDÉS DE PRÉPARATION, COMPOSITIONS PHARMACEUTIQUES ET UTILISATIONS EN TANT QU'INHIBITEURS DE VIRUS DE L'HÉPATITE
  申请人：SHANGHAI INST MATERIA MEDICA

  公开号：WO2011116663A1

  公开（公告）日：2011-09-29

  本发明属于药物化学领域，涉及一类如下通式I所示的2'，2－双噻唑非核苷类化合物及其制备方法，以及包含该类化合物的药物组合物，该类化合物同时具有抗乙型肝炎病毒和抗丙型肝炎病毒的活性，可用于治疗乙型肝炎和丙型肝炎，且药代学试验显示该类化合物具有良好的生物利用度。
• Heterocyclic Non-Nucleoside Compounds, Their Preparation, Pharmaceutical Composition And Their Use As Antiviral Agents
  申请人：Nan Fajun

  公开号：US20100056569A1

  公开（公告）日：2010-03-04

  The invention relates a kind of antiviral agents, more concretely, relates to a kind of heterocyclic non-nucleoside compounds with the following structures, their preparation and pharmaceutical compositions including the compounds. The said compounds can be used as antiviral agents and as medicaments for treating diseases such as hepatitis B, influenza, herpes, HIV and so on.
• Pharmaceutical Use of 2',2-Bis-Thiazole Non-Nucleoside Compounds as Hepatitis C Virus Inhibitor
  申请人：Nan Fajun

  公开号：US20120264793A1

  公开（公告）日：2012-10-18

  The present invention discloses the pharmaceutical use of a 2′,2-bis-thiazole non-nucleoside compound of formula I as an inhibitor of hepatitis C virus (HCV). The 2′,2-bis-thiazole non-nucleoside compound can inhibit the replication of HCV, and thus has an anti-HCV activity and is useful for treating hepatitis C.