4-(2-methanesulfinyl-benzothiazol-6-yloxy)-pyridine-2-carboxylic acid methylamide | 953770-87-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 4-(2-methanesulfinyl-benzothiazol-6-yloxy)-pyridine-2-carboxylic acid methylamide
• 英文别名: 2-Pyridinecarboxamide, N-methyl-4-[[2-(methylsulfinyl)-6-benzothiazolyl]oxy]-；N-methyl-4-[(2-methylsulfinyl-1,3-benzothiazol-6-yl)oxy]pyridine-2-carboxamide
• CAS: 953770-87-1
• 化学式: C₁₅H₁₃N₃O₃S₂
• 分子量: 347.419
• InChiKey: NIEXOVSIEZOJBB-UHFFFAOYSA-N

物化性质

• 密度：
  1.51±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  23
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  129
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  4-(2-methanesulfinyl-benzothiazol-6-yloxy)-pyridine-2-carboxylic acid methylamide 、 环己甲胺 以 N,N-二甲基甲酰胺 为溶剂， 反应 16.0h， 生成 4-[2-(cyclohexylmethyl-amino)-benzothiazol-6-yloxy]-pyridine-2-carboxylic acid methylamide
  参考文献：
  名称：

  6-O-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling

  摘要：

  本文披露了苯并噁唑和苯并噻唑化合物及其立体异构体、互变异构体、溶剂化物、氧化物、酯类和前药以及其药学上可接受的盐。本文还披露了该化合物的组合物，其可以单独使用或与至少一种其他治疗剂联合使用，并与药学上可接受的载体一起使用，以及该化合物的用途，可以单独使用或与至少一种其他治疗剂联合使用，用于抑制细胞增殖，抑制肿瘤的生长和/或代谢，治疗或预防癌症，治疗或预防类风湿性关节炎等退化性骨疾病，以及抑制CSF-1R等分子。

  公开号：

  US08173689B2
• 作为产物：
  描述：

  N-甲基-4-((2-(甲硫基)苯并[D]噻唑-6-基)氧基)吡啶-2-甲酰胺 以quant.的产率得到4-(2-methanesulfinyl-benzothiazol-6-yloxy)-pyridine-2-carboxylic acid methylamide
  参考文献：
  名称：

  6-O-Substituted Benzoxazole and Benzothiazole Compounds and Methods of Inhibiting CSF-1R Signaling

  摘要：

  公开了苯并噻唑化合物和苯并噻唑类化合物的立体异构体、互变异构体、溶剂化物、氧化物、酯和前药及其药学上可接受的盐。还公开了这些化合物的组合物，其可以与至少一种额外的治疗剂一起使用，并与药学上可接受的载体结合使用。这些实施例对于抑制细胞增殖、抑制肿瘤的生长和/或代谢、治疗或预防癌症、治疗或预防退化性骨疾病如类风湿性关节炎以及/或抑制CSF-1R等分子具有用途。

  公开号：

  US20120225861A1

文献信息

• [EN] CELLULAR SIGNALLING INHIBITORS, THEIR FORMULATIONS AND METHODS THEREOF<br/>[FR] INHIBITEURS DE SIGNALISATION CELLULAIRE, LEURS FORMULES ET LEURS PROCÉDÉS
  申请人：INVICTUS ONCOLOGY PVT LTD

  公开号：WO2017137958A1

  公开（公告）日：2017-08-17

  The present disclosure relates generally to Cellular Signalling inhibitors of compound of Formula (I), compositions and formulations comprising the same, methods, processes, and uses thereof. In particular, the present disclosure provides CSF-1R inhibitors demonstrating sustained inhibition of CSF/CSF1R signalling pathway with decreased toxicity. The present disclosure also provides supramolecular combinatorial therapeutics, wherein a CSF-1R inhibitor is combined with one or more of a chemotherapeutic agent, a kinase inhibitor, and an immunoregulator, each of which is optionally conjugated with a lipid. The present disclosure also provides a method for treating cancer, allergy, Systemic lupus erythematosus, nephritis, Chronic Obstructive Pulmonary Disease, and abnormal macrophage functions or any combinations thereof.

  本公开涉及一般细胞信号传导抑制剂，涉及式(I)的化合物、包含该化合物的组合物和制剂、以及它们的方法、过程和使用。特别是，本公开提供了CSF-1R抑制剂，它们表现出对CSF/CSF1R信号通路的持续抑制，并且毒性降低。本公开还提供了超分子组合疗法，其中CSF-1R抑制剂与一个或多个化疗剂、激酶抑制剂和免疫调节剂结合，其中每个可选地与脂质偶联。本公开还提供了一种治疗癌症、过敏、系统性红斑狼疮、肾炎、慢性阻塞性肺病和异常巨噬细胞功能或其任何组合的方法。
• 6-O-SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AND METHODS OF INHIBITING CSF-1R SIGNALING
  申请人：Sutton C James

  公开号：US20080045528A1

  公开（公告）日：2008-02-21

  Benzoxazole and benzothiazole compounds and the stereoisomers, tautomers, solvates, oxides, esters, and prodrugs thereof and pharmaceutically acceptable salts thereof are disclosed. Compositions of the compounds, either alone or in combination with at least one additional therapeutic agent, with a pharmaceutically acceptable carrier, and uses of the compounds, either alone or in combination with at least one additional therapeutic agent are also disclosed. The embodiments are useful for inhibiting cellular proliferation, inhibiting the growth and/or metathesis of tumors, treating or preventing cancer, treating or preventing degenerating bone diseases such as rheumatoid arthritis, and/or inhibiting molecules such as CSF-1R.

  苯并噁唑和苯并噻唑化合物及其立体异构体、互变异构体、溶剂合物、氧化物、酯类和前药以及其药学上可接受的盐已被披露。所述化合物的组合物，无论是单独使用还是与至少一种额外治疗剂组合，并与药学上可接受的载体一起使用的用途也已被披露。这些实施例可用于抑制细胞增殖，抑制肿瘤的生长和/或交换反应，治疗或预防癌症，治疗或预防类风湿性关节炎等退行性骨病，以及/或抑制CSF-1R等分子。
• 6-O-Substituted Benzoxazole and Benzothiazole Compounds and Methods of Inhibiting CSF-1R Signaling
  申请人：Sutton James C.

  公开号：US20120225861A1

  公开（公告）日：2012-09-06

  Benzoxazole and benzothiazole compounds and the stereoisomers, tautomers, solvates, oxides, esters, and prodrugs thereof and pharmaceutically acceptable salts thereof are disclosed. Compositions of the compounds, either alone or in combination with at least one additional therapeutic agent, with a pharmaceutically acceptable carrier, and uses of the compounds, either alone or in combination with at least one additional therapeutic agent are also disclosed. The embodiments are useful for inhibiting cellular proliferation, inhibiting the growth and/or metathesis of tumors, treating or preventing cancer, treating or preventing degenerating bone diseases such as rheumatoid arthritis, and/or inhibiting molecules such as CSF-1R.

  公开了苯并噻唑化合物和苯并噻唑类化合物的立体异构体、互变异构体、溶剂化物、氧化物、酯和前药及其药学上可接受的盐。还公开了这些化合物的组合物，其可以与至少一种额外的治疗剂一起使用，并与药学上可接受的载体结合使用。这些实施例对于抑制细胞增殖、抑制肿瘤的生长和/或代谢、治疗或预防癌症、治疗或预防退化性骨疾病如类风湿性关节炎以及/或抑制CSF-1R等分子具有用途。
• Cellular signalling inhibitors, their formulations and methods thereof
  申请人：INVICTUS ONCOLOGY PVT. LTD.

  公开号：US10736968B2

  公开（公告）日：2020-08-11

  The present disclosure relates generally to Cellular Signalling inhibitors of compound of Formula I, compositions and formulations comprising the same, methods, processes, and uses thereof. In particular, the present disclosure provides CSF-1R inhibitors demonstrating sustained inhibition of CSF/CSF1R signalling pathway with decreased toxicity. The present disclosure also provides supramolecular combinatorial therapeutics, wherein a CSF-1R inhibitor is combined with one or more of a chemotherapeutic agent, a kinase inhibitor, and an immunoregulator, each of which is optionally conjugated with a lipid. The present disclosure also provides a method for treating cancer, allergy, Systemic lupus erythematosus, nephritis, Chronic Obstructive Pulmonary Disease, and abnormal macrophage functions or any combinations thereof.

  本公开总体上涉及式 I 化合物的细胞信号抑制剂、由其组成的组合物和制剂、方法、工艺及其用途。特别是，本公开提供的 CSF-1R 抑制剂可持续抑制 CSF/CSF1R 信号通路并降低毒性。本公开内容还提供了超分子组合疗法，其中 CSF-1R 抑制剂与化疗剂、激酶抑制剂和免疫调节剂中的一种或多种结合，每种抑制剂都可选与脂质共轭。本公开还提供了一种治疗癌症、过敏、系统性红斑狼疮、肾炎、慢性阻塞性肺病和巨噬细胞功能异常或其任意组合的方法。
• CELLULAR SIGNALLING INHIBITORS, THEIR FORMULATIONS AND METHODS THEREOF
  申请人：INVICTUS ONCOLOGY PVT. LTD.

  公开号：US20190046650A1

  公开（公告）日：2019-02-14

  The present disclosure relates generally to Cellular Signalling inhibitors of compound of Formula (I), compositions and formulations comprising the same, methods, processes, and uses thereof. In particular, the present disclosure provides CSF-1R inhibitors demonstrating sustained inhibition of CSF/CSF1R signalling pathway with decreased toxicity. The present disclosure also provides supramolecular combinatorial therapeutics, wherein a CSF-1R inhibitor is combined with one or more of a chemotherapeutic agent, a kinase inhibitor, and an immunoregulator, each of which is optionally conjugated with a lipid. The present disclosure also provides a method for treating cancer, allergy, Systemic lupus erythematosus, nephritis, Chronic Obstructive Pulmonary Disease, and abnormal macrophage functions or any combinations thereof.