6-bromo-1-(3-methoxypropyl)-3-methyl-1H-indole | 1013923-79-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 6-bromo-1-(3-methoxypropyl)-3-methyl-1H-indole
• 英文别名: 6-bromo-1-(3-methoxypropyl)-3-methylindole
• CAS: 1013923-79-9
• 化学式: C₁₃H₁₆BrNO
• 分子量: 282.18
• InChiKey: IXMNYUGRQSKSCY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  14.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  6-bromo-1-(3-methoxypropyl)-3-methyl-1H-indole 、 2-丙炔-1-醇 在 四(三苯基膦)钯 四氢吡咯 作用下， 反应 21.0h， 生成 3-[1-(3-methoxypropyl)-3-methyl-1H-indol-6-yl]prop-2-yn-1-ol
  参考文献：
  名称：

  WO2008/55939

  摘要：

  公开号：

文献信息

• Amino alcohols and their use as renin inhibitors
  申请人：Speedel Experimenta AG

  公开号：EP1911762A1

  公开（公告）日：2008-04-16

  The invention provides substituted amino alcohols of the general formula (I) and the salts thereof, preferably the pharmaceutically acceptable salts thereof; where R2, R3, Q, T, X and Z have the definitions elucidated in more detail in the description, to a process for their preparation and to the use of these compounds as medicines, in particular as renin inhibitors. Moreover, the enzymatic substrate portion of the compound is simultaneously a substrate for a membrane transporter.

  本发明提供了一般式(I)及其盐的取代氨基醇，优选为其药学上可接受的盐。其中，R2、R3、Q、T、X和Z的定义在说明书中有更详细的阐述，以及其制备方法和这些化合物作为药物的用途，特别是作为肾素抑制剂。此外，该化合物的酶底物部分同时也是膜转运体的底物。
• Nitrate esters of aminoalcohols
  申请人：Herold Peter

  公开号：US20090318432A1

  公开（公告）日：2009-12-24

  The application relates to novel nitrate ester derivatives of substituted aminoalcohols of the general formula (I), wherein R 1 , R 2 , R 3 , V, X, Y and Z 0 have the meanings explained in more detail in the description, to a process for their preparation and to the use of these compounds as therapeutics in cardiovascular diseases, in particular in high blood pressure and vascular and organ damage age accompanying high blood pressure.

  该申请涉及一种新型硝酸酯衍生物，其为通式（I）中的取代氨基醇衍生物，其中R1、R2、R3、V、X、Y和Z0的含义在说明中有更详细的解释，以及它们的制备方法和将这些化合物作为治疗剂用于心血管疾病，特别是高血压和伴随高血压的血管和器官损伤的用途。
• Organic Compounds
  申请人：Herold Peter

  公开号：US20080058320A1

  公开（公告）日：2008-03-06

  The invention relates to novel amino alcohols of the general formula (I) where X, R 1 , R 2 , R 3 , R 4 , R 5 and R 6 are each as defined in detail in the description, to a process for their preparation and to the use of these compounds as medicines, in particular as renin inhibitors.

  本发明涉及一种新型的氨基醇，其通式为(I)，其中X，R1，R2，R3，R4，R5和R6分别如详细描述中所定义，以及其制备方法和这些化合物作为药物的用途，特别是作为肾素抑制剂。
• 5-Amino-4-Hydroxy-7-(1H-Indolmethyl)-8-Methylnonamide Derivatives as Renin Inhibitors for the Treatment of Hypertension
  申请人：Herold Peter

  公开号：US20080280895A1

  公开（公告）日：2008-11-13

  The application relates to novel alkanamides of the general formula (I) where X is —CH 2 — or >CH—OH; (A) R 1 is e.g. an optionally substituted heterocyclyl radical or an optionally substituted polycyclic, unsaturated hydrocarbon radical where X is hydroxymethylene; R 2 is C 1 -C 6 -alkyl or C 3 -C 6 -cydoalkyl; R 3 are each independently H, C 1 -C 6 -alkyl, C 1-6 -alkoxycarbonyl or C 1 -C 6 -alkanoyl; R 4 is C 1 -C 6 -alkyl, C 3 -C 6 -cycloalkyl, C 2 -C 6 -alkenyl or unsubstituted or substituted arylC 1 -C 6 -alkyl; R 5 is C 1 -C 6 -alkyl, C 1 -C 6 -hydroxyalkyl, C 1 -C 6 -alkoxy-C 1 -C 6 -alkyl, C 1 -C 6 -alkanoyloxy C 1 -C 6 -alkyl, C 1 -C 6 -aminoalkyl, C 1 -C 6 -alkylamino-C 1 -C 6 -alkyl, C 1 -C 6 -dialkylamino-C 1 -C 6 -alkyl, C 1 -C 6 -alkanoylamido-C 1 -C 6 -alkyl, HO(O)C—C 1 -C 6 -alkyl, C 1 -C 6 -alkyl-O—(O)C—C 1 -C 6 -alkyl, H 2 N—C(O)—C 1 -C 6 -alkyl, C 1 -C 6 -alkyl-HN—C(O)—C 1 -C 6 -alkyl, (C 1 , —C 6 -alkyl) 2 N—C(O)—C 1 -C 6 -alkyl, C 2 -C 8 -alkenyl, C 2 -C 8 -alkynyl, cyano-C 1 -C 6 -alkyl, halo-C 1 -C 6 -alkyl, optionally substituted aryl-C o -C 6 -alkyl, optionally substituted C 3 -C 8 -cycloalkyl-C o -C 6 -alkyl or optionally substituted heterocydyl-C o -C 6 -alkyl; to a process for their preparation and to the use of these compounds as medicines, especially as renin inhibitors for the treatment of hypertension.

  该申请涉及到通式（I）的新型烷基酰胺，其中X为—CH2—或>CH—OH；（A）R1为例如可选择取代的杂环基基团或可选择取代的多环不饱和碳氢基团，其中X为羟甲基；R2为C1-C6-烷基或C3-C6-环烷基；R3各自独立地为H、C1-C6-烷基、C1-6-烷氧羰基或C1-C6-酰基；R4为C1-C6-烷基、C3-C6-环烷基、C2-C6-烯基或未取代或取代的芳基C1-C6-烷基；R5为C1-C6-烷基、C1-C6-羟基烷基、C1-C6-烷氧基-C1-C6-烷基、C1-C6-酰氧-C1-C6-烷基、C1-C6-氨基烷基、C1-C6-烷基氨基-C1-C6-烷基、C1-C6-二烷基氨基-C1-C6-烷基、C1-C6-酰胺基-C1-C6-烷基、HO(O)C—C1-C6-烷基、C1-C6-烷基-O—(O)C—C1-C6-烷基、H2N—C(O)—C1-C6-烷基、C1-C6-烷基-HN—C(O)—C1-C6-烷基、（C1，—C6-烷基）2N—C(O)—C1-C6-烷基、C2-C8-烯基、C2-C8-炔基、氰基-C1-C6-烷基、卤代-C1-C6-烷基、可选择取代的芳基-Co-C6-烷基、可选择取代的C3-C8-环烷基-Co-C6-烷基或可选择取代的杂环基-Co-C6-烷基；以及它们的制备方法和这些化合物作为药物的用途，特别是作为肾素抑制剂治疗高血压。
• 2,7-SUBSTITUTED 5-AMINO-4-HYDROXY-8-(1H-INDOL-5-YL)-OCTAN AMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION
  申请人：Speedel Experimenta AG

  公开号：EP1717226A1

  公开（公告）日：2006-11-02

  The application relates to novel alkanamides of the general formula where X, R1, R2, R3, R4 and R5 are each as defined in detail in the description, to a process for their preparation and to the use of these compounds as medicines, especially as renin inhibitors.

  本申请涉及通式如下的新型烷酰胺 式中 X、R1、R2、R3、R4 和 R5 各为在描述中详细定义的字母，涉及其制备工艺以及这些化合物作为药物，特别是作为肾素抑制剂的用途。