N-(2-hydroxy-2-methyl-propyl)-ethyl-carbamate

• 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: N-(2-hydroxy-2-methyl-propyl)-ethyl-carbamate
• 英文别名: ethyl (2-hydroxy-2-methylpropyl)carbamate；ethyl N-(2-hydroxy-2-methylpropyl)carbamate
• 化学式: C₇H₁₅NO₃
• 分子量: 161.201
• InChiKey: QTHNQFWKFUBQQN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.2
• 重原子数：
  11
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  58.6
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  碘苯 、 N-(2-hydroxy-2-methyl-propyl)-ethyl-carbamate 在 copper(l) iodide 、 2,2,6,6-四甲基-3,5-庚二酮 、 caesium carbonate 作用下， 以 乙腈 为溶剂， 反应 20.0h， 以88%的产率得到5,5-dimethyl-3-phenyl-1,3-oxazolidin-2-one
  参考文献：
  名称：

  铜催化氨基醇氨基甲酸酯一锅法合成N-芳基恶唑烷酮

  摘要：

  已经开发出在氨基甲酸酯氨基甲酸酯的有效顺序分子内环化，然后在温和条件下与芳基碘化物进行铜催化的交叉偶联。该反应以高收率进行，并且可以耐受含有官能团（例如腈，酮，醚和卤素）的芳基碘化物。杂芳基碘化物和取代的氨基醇氨基甲酸酯也被很好地耐受。

  DOI：

  10.1021/ol502322c
• 作为产物：
  描述：

  2-((乙氧基羰基)氨基)乙酸甲酯 、 甲基氯化镁 以 四氢呋喃 为溶剂， 反应 2.5h， 以73%的产率得到N-(2-hydroxy-2-methyl-propyl)-ethyl-carbamate
  参考文献：
  名称：

  铜催化氨基醇氨基甲酸酯一锅法合成N-芳基恶唑烷酮

  摘要：

  已经开发出在氨基甲酸酯氨基甲酸酯的有效顺序分子内环化，然后在温和条件下与芳基碘化物进行铜催化的交叉偶联。该反应以高收率进行，并且可以耐受含有官能团（例如腈，酮，醚和卤素）的芳基碘化物。杂芳基碘化物和取代的氨基醇氨基甲酸酯也被很好地耐受。

  DOI：

  10.1021/ol502322c

文献信息

• [EN] 2 - (2, 4, 5 - SUBSTITUTED -ANILINO) PYRIMIDINE DERIVATIVES AS EGFR MODULATORS USEFUL FOR TREATING CANCER<br/>[FR] DÉRIVÉS DE 2-(ANILINO 2,4,5-SUBSTITUÉ)PYRIMIDINE UTILISÉS COMME MODULATEURS DE L'EGFR UTILES POUR LE TRAITEMENT D'UN CANCER
  申请人：ASTRAZENECA AB

  公开号：WO2013014448A1

  公开（公告）日：2013-01-31

  The present invention relates to certain 2-(2,4,5-substituted-anilino) pyrimidine compounds and pharmaceutically acceptable salts thereof which may be useful in the treatment or prevention of a disease or medical condition mediated through certain mutated forms of epidermal growth factor receptor (for example the L858R activating mutant, the Exonl9 deletion activating mutant and the T790M resistance mutant). Such compounds and salts thereof may be useful in the treatment or prevention of a number of different cancers. The invention also relates to pharmaceutical compositions comprising said compounds and salts thereof, especially useful polymorphic forms of these compounds and salts, intermediates useful in the manufacture of said compounds and to methods of treatment of diseases mediated by various different forms of EGFR using said compounds and salts thereof.

  本发明涉及某些2-(2,4,5-取代苯胺基)嘧啶化合物及其药学上可接受的盐，这些化合物可能在治疗或预防通过某些突变形式的表皮生长因子受体介导的疾病或医疗状况中有用（例如L858R激活突变体、Exonl9缺失激活突变体和T790M耐药突变体）。这些化合物及其盐可能在治疗或预防多种不同癌症方面有用。该发明还涉及包含所述化合物和盐的药物组合物，特别是这些化合物和盐的有用多形式，用于制造所述化合物的中间体，以及使用所述化合物和盐治疗通过各种不同形式的EGFR介导的疾病的方法。
• 2-(2,4,5-SUBSTITUTED-ANILINO) PYRIMIDINE COMPOUNDS
  申请人：BUTTERWORTH Sam

  公开号：US20130053409A1

  公开（公告）日：2013-02-28

  The present invention relates to certain 2-(2,4,5-substituted-anilino)pyrimidine compounds and pharmaceutically acceptable salts thereof which may be useful in the treatment or prevention of a disease or medical condition mediated through certain mutated forms of epidermal growth factor receptor (for example the L858R activating mutant, the Exon19 deletion activating mutant and the T790M resistance mutant). Such compounds and salts thereof may be useful in the treatment or prevention of a number of different cancers. The invention also relates to pharmaceutical compositions comprising said compounds and salts thereof, especially useful polymorphic forms of these compounds and salts, intermediates useful in the manufacture of said compounds and to methods of treatment of diseases mediated by various different forms of EGFR using said compounds and salts thereof.

  本发明涉及某些2-(2,4,5-取代苯胺基)嘧啶化合物及其药学上可接受的盐，这些化合物可能对通过某些突变表皮生长因子受体介导的疾病或医疗状况（例如L858R激活突变体、Exon19缺失激活突变体和T790M耐药突变体）的治疗或预防有用。这些化合物及其盐可能对多种不同的癌症的治疗或预防有用。本发明还涉及包含这些化合物及其盐的药物组合物，特别是这些化合物及其盐的有用多形式，以及用于制造这些化合物的中间体和使用这些化合物及其盐治疗通过不同形式的EGFR介导的疾病的方法。
• 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS
  申请人：AstraZeneca AB

  公开号：US20150119379A1

  公开（公告）日：2015-04-30

  The present invention relates to certain 2-(2,4,5-substituted-anilino)pyrimidine compounds and pharmaceutically acceptable salts thereof which may be useful in the treatment or prevention of a disease or medical condition mediated through certain mutated forms of epidermal growth factor receptor (for example the L858R activating mutant, the Exon19 deletion activating mutant and the T790M resistance mutant). Such compounds and salts thereof may be useful in the treatment or prevention of a number of different cancers. The invention also relates to pharmaceutical compositions comprising said compounds and salts thereof, especially useful polymorphic forms of these compounds and salts, intermediates useful in the manufacture of said compounds and to methods of treatment of diseases mediated by various different forms of EGFR using said compounds and salts thereof.

  本发明涉及某些2-(2,4,5-取代苯胺基)嘧啶化合物及其药学上可接受的盐，可用于治疗或预防通过某些突变的表皮生长因子受体介导的疾病或医疗情况（例如L858R激活突变体、Exon19缺失激活突变体和T790M耐药突变体）。这些化合物及其盐可用于治疗或预防多种不同类型的癌症。本发明还涉及包含所述化合物和盐的制药组合物，特别是这些化合物和盐的有用多晶形式，以及用于制造所述化合物的中间体和使用所述化合物和盐治疗不同形式EGFR介导的疾病的方法。
• 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE DERIVATIVES AS EGFR MODULATORS USEFUL FOR TREATING CANCER
  申请人：Astrazeneca AB

  公开号：EP3009431A1

  公开（公告）日：2016-04-20

  The present invention relates to certain 2-(2,4,5-substituted-anilino)pyrimidine compounds and pharmaceutically acceptable salts thereof which may be useful in the treatment or prevention of a disease or medical condition mediated through certain mutated forms of epidermal growth factor receptor (for example the L858R activating mutant, the Exonl9 deletion activating mutant and the T790M resistance mutant). Such compounds and salts thereof may be useful in the treatment or prevention of a number of different cancers. The invention also relates to pharmaceutical compositions comprising said compounds and salts thereof, especially useful polymorphic forms of these compounds and salts, intermediates useful in the manufacture of said compounds and to methods of treatment of diseases mediated by various different forms of EGFR using said compounds and salts thereof.

  本发明涉及某些2-(2,4,5-取代-苯胺基)嘧啶化合物及其药学上可接受的盐类，它们可用于治疗或预防通过某些突变形式的表皮生长因子受体（例如L858R激活突变体、Exonl9缺失激活突变体和T790M抗性突变体）介导的疾病或医疗状况。此类化合物及其盐类可用于治疗或预防多种不同的癌症。本发明还涉及包含上述化合物及其盐类的药物组合物、特别有用的这些化合物及其盐类的多态形式、用于制造上述化合物的中间体，以及使用上述化合物及其盐类治疗由各种不同形式的表皮生长因子受体介导的疾病的方法。
• 2-(2,4,5-substituted-anilino)pyrimidine compounds
  申请人：AstraZeneca AB

  公开号：US10017493B2

  公开（公告）日：2018-07-10

  The present invention relates to certain 2-(2,4,5-substituted-anilino)pyrimidine compounds and pharmaceutically acceptable salts thereof which may be useful in the treatment or prevention of a disease or medical condition mediated through certain mutated forms of epidermal growth factor receptor (for example the L858R activating mutant, the Exon19 deletion activating mutant and the T790M resistance mutant). Such compounds and salts thereof may be useful in the treatment or prevention of a number of different cancers. The invention also relates to pharmaceutical compositions comprising said compounds and salts thereof, especially useful polymorphic forms of these compounds and salts, intermediates useful in the manufacture of said compounds and to methods of treatment of diseases mediated by various different forms of EGFR using said compounds and salts thereof.

  本发明涉及某些2-(2,4,5-取代-苯胺基)嘧啶化合物及其药学上可接受的盐类，它们可用于治疗或预防通过某些突变形式的表皮生长因子受体（例如L858R激活突变体、Exon19缺失激活突变体和T790M抗性突变体）介导的疾病或医疗状况。此类化合物及其盐类可用于治疗或预防多种不同的癌症。本发明还涉及包含上述化合物及其盐类的药物组合物、特别有用的这些化合物及其盐类的多态形式、用于制造上述化合物的中间体，以及使用上述化合物及其盐类治疗由各种不同形式的表皮生长因子受体介导的疾病的方法。