5-[4-(1-tert-butoxycarbonylamino-1-methylethyl)-phenyl]-4-methylcarbonyl-2-(tetrahydropyran-2-yl)-2H-indazole | 850361-10-3

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: 5-[4-(1-tert-butoxycarbonylamino-1-methylethyl)-phenyl]-4-methylcarbonyl-2-(tetrahydropyran-2-yl)-2H-indazole
• 英文别名: tert-butyl N-[2-[4-[4-acetyl-2-(oxan-2-yl)indazol-5-yl]phenyl]propan-2-yl]carbamate
• CAS: 850361-10-3
• 化学式: C₂₈H₃₅N₃O₄
• 分子量: 477.604
• InChiKey: OMBRLTWNJPOUJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  35
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  82.4
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  5-[4-(1-tert-butoxycarbonylamino-1-methylethyl)-phenyl]-4-methylcarbonyl-2-(tetrahydropyran-2-yl)-2H-indazole 、 N,N-二甲基甲酰胺二甲基缩醛 以 N,N-二甲基甲酰胺 为溶剂， 反应 5.5h， 以81%的产率得到5-[4-(1-tert-butoxycarbonylamino-1-methylethyl)phenyl]-4-(3-dimethylaminoacryloyl)-2-(tetrahydropyran-2-yl)-2H-indazole
  参考文献：
  名称：

  EP1870099

  摘要：

  公开号：

文献信息

• Protective Agent for Retinal Neuronal Cell Comprising Indazole Derivative as Active Ingredient
  申请人：Seike Hisayuki

  公开号：US20090012123A1

  公开（公告）日：2009-01-08

  As a result of intensive studies for the purpose of finding a new medicinal use of an indazole derivative, it was found that an indazole derivative inhibits glutamate-induced retinal neuronal cell death in rat fetal retinal neuronal cells, in other words, the indazole derivative acts directly on the retinal neuronal cells and exhibits an effect of protecting retinal neuronal cells. Accordingly, the indazole derivative is useful for the prevention or treatment of an eye disease associated with retinal neuronal cell damage or retinal damage.

  经过对吲唑衍生物进行深入研究，目的是寻找其新的药用价值。研究发现，吲唑衍生物在大鼠胎儿视网膜神经细胞中能够抑制谷氨酸诱导的视网膜神经细胞死亡，换句话说，吲唑衍生物直接作用于视网膜神经细胞，并显示出保护视网膜神经细胞的效果。因此，吲唑衍生物对于预防或治疗与视网膜神经细胞损伤或视网膜损伤相关的眼病是有用的。
• Novel indazole derivatives
  申请人：Hagihara Masahiko

  公开号：US20070129404A1

  公开（公告）日：2007-06-07

  An object of the present invention is to create a novel indazole derivative useful as a drug and to find a novel pharmacological action of the derivative. The compound of the present invention is represented by the formula [I] and has an excellent Rho kinase inhibiting action. In the formula, a ring X is a benzene ring or a pyridine ring; R 1 and R 2 are H or alkyl; R 3 and R 4 are halogen, H, OH, alkoxy, alkenyloxy, alkynyloxy, cycloalkyloxy, cycloalkenyloxy, aryloxy, alkyl, alkenyl, alkynyl, cycloalkyl, cycloalkenyl, aryl, carboxy, hydrocarbonyl, alkylcarbonyl, etc.; and R 5 is halogen atom, H, OH, alkoxy, aryloxy, alkyl or aryl. Each group can be substituted.

  本发明的目的是创建一种新的吲唑衍生物作为药物，并找到该衍生物的新的药理作用。本发明的化合物由公式[I]表示，并具有出色的Rho激酶抑制作用。在公式中，环X是苯环或吡啶环；R1和R2是H或烷基；R3和R4是卤素，H，OH，烷氧基，烯氧基，炔氧基，环烷氧基，环烯氧基，芳氧基，烷基，烯基，炔基，环烷基，环烯基，芳基，羧基，烷基羰基等；而R5是卤素原子，H，OH，烷氧基，芳氧基，烷基或芳基。每个基团都可以被取代。
• PROTECTIVE AGENT FOR RETINAL NEURONAL CELL COMPRISING INDAZOLE DERIVATIVE AS ACTIVE INGREDIENT
  申请人：Ube Industries, Ltd.

  公开号：EP1870099A1

  公开（公告）日：2007-12-26

  As a result of intensive studies for the purpose of finding a new medicinal use of an indazole derivative, it was found that an indazole derivative inhibits glutamate-induced retinal neuronal cell death in rat fetal retinal neuronal cells, in other words, the indazole derivative acts directly on the retinal neuronal cells and exhibits an effect of protecting retinal neuronal cells. Accordingly, the indazole derivative is useful for the prevention or treatment of an eye disease associated with retinal neuronal cell damage or retinal damage.

  为了寻找一种吲唑衍生物的新药用用途而进行的深入研究发现，吲唑衍生物可抑制谷氨酸诱导的大鼠胎儿视网膜神经细胞死亡，换句话说，吲唑衍生物直接作用于视网膜神经细胞，并显示出保护视网膜神经细胞的效果。因此，吲唑衍生物可用于预防或治疗与视网膜神经元细胞损伤或视网膜损伤有关的眼病。
• Novel indazole derivative
  申请人：UBE INDUSTRIES, LTD.

  公开号：EP2468729A1

  公开（公告）日：2012-06-27

  The invention relates to compounds of formula (I): in which R1, R2, R3, R4, R5 and X are as defined in the description. These compounds are useful as Rho kinase inhibitors.

  本发明涉及式 (I) 化合物： 其中 R1、R2、R3、R4、R5 和 X 如描述中所定义。这些化合物可用作 Rho 激酶抑制剂。
• NOVEL INDAZOLE DERIVATIVE
  申请人：Ube Industries, Ltd.

  公开号：EP1679308B1

  公开（公告）日：2013-07-24