1-tert-butoxycarbonylamino-6-hydroxyheptane | 364385-61-5

• 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: 1-tert-butoxycarbonylamino-6-hydroxyheptane
• 英文别名: tert-butyl N-(6-hydroxyheptyl)carbamate
• CAS: 364385-61-5
• 化学式: C₁₂H₂₅NO₃
• 分子量: 231.335
• InChiKey: FJMAIZKRMSRGHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  16
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  58.6
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  tert-butyl 6-oxohexylcarbamate 在 甲基溴化镁 作用下， 以 四氢呋喃 、 水 为溶剂， 生成 1-tert-butoxycarbonylamino-6-hydroxyheptane
  参考文献：
  名称：

  Heterocycle derivatives and drugs

  摘要：

  提供了一种出色的新型镇痛药，具有对疼痛产生镇痛作用的效果，广泛对抗各种疼痛，包括慢性疼痛或伴随带状疱疹的痛觉过敏，通过作用于一种痛觉素受体。本发明涉及以下式表示的化合物或其盐。在该式中，X和Y相同或不同，每个代表一个氮原子或CH；R1代表一个氢原子或烷基等；A1和A2相同或不同，每个代表一个单键或双价脂肪烃基；Q代表一个单键，环烷基，苯基或双价杂环基；R2A，R2B，R2C和R2D相同或不同，每个代表一个氢原子，烷基或苯基；E代表一个乙烯基或—NRCO—（其中R为氢或烷基）等；R3代表一个苯基或杂环基；R4和R5相同或不同，每个代表一个氢原子，烷基，烷氧基，芳基氧基，卤素，硝基，羟基，烷氧羰基，—NR6R7（其中R6和R7相同或不同，每个代表一个氢原子或烷基）等。

  公开号：

  US20030119855A1

文献信息

• Quinazoline derivatives and drugs
  申请人：Nippon Shinyaku Co., Ltd.

  公开号：US06794389B2

  公开（公告）日：2004-09-21

  There is provided an excellent novel analgesic having an analgesic effect which is effective widely against a pain including a chronic pain or an allodynia accompanied with herpes zoster by acting on a nociceptin receptor. The present invention relates to a compound represented by the following formula: or a salt thereof. In the formula, X and Y are same or different and each represents a nitrogen atom or CH; R1 represents a hydrogen atom or alkyl and the like; A1 and A2 are same or different and each represents a single bond or a divalent aliphatic hydrocarbon group; Q represents a single bond, cycloalkylene group, phenylene group or divalent heterocyclic group; R2A, R2B, R2C and R2D are same or different and each represents a hydrogen atom, alkyl or phenyl; E represents a ethenylene group or —NRCO— (in which R is hydrogen or alkyl) and the like; R3 represents a phenyl group or a heterocyclic group; R4 and R5 are same or different and each represents a hydrogen atom, alkyl, alkoxy, aralkyloxy, halogen, nitro, hydroxy, alkoxycarbonyl, —NR6R7 (in which R6 and R7 are same or different and each represents a hydrogen atom or alkyl) and the like.

  提供了一种出色的新型止痛剂，具有广泛的止痛效果，可用于治疗包括带状疱疹伴随的慢性疼痛或痛觉过敏等疼痛。该止痛剂通过作用于nociceptin受体来发挥作用。本发明涉及以下公式所表示的化合物或其盐。在该公式中，X和Y相同或不同，每个代表氮原子或CH; R1代表氢原子或烷基等; A1和A2相同或不同，每个代表单键或二价脂肪烃基; Q代表单键，环烷基，苯基或二价杂环基; R2A，R2B，R2C和R2D相同或不同，每个代表氢原子，烷基或苯基; E代表乙烯基或—NRCO—（其中R为氢或烷基）等; R3代表苯基或杂环基; R4和R5相同或不同，每个代表氢原子，烷基，烷氧基，芳基烷氧基，卤素，硝基，羟基，烷氧羰基，—NR6R7（其中R6和R7相同或不同，每个代表氢原子或烷基）等。
• HETEROCYCLE DERIVATIVES AND DRUGS
  申请人：Nippon Shinyaku Co., Ltd.

  公开号：EP1306372B1

  公开（公告）日：2009-11-18
• US6794389B2
  申请人：——

  公开号：US6794389B2

  公开（公告）日：2004-09-21
• Heterocycle derivatives and drugs
  申请人：——

  公开号：US20030119855A1

  公开（公告）日：2003-06-26

  There is provided an excellent novel analgesic having an analgesic effect which is effective widely against a pain including a chronic pain or an allodynia accompanied with herpes zoster by acting on a nociceptin receptor. The present invention relates to a compound represented by the following formula: 1 or a salt thereof. In the formula, X and Y are same or different and each represents a nitrogen atom or CH; R 1 represents a hydrogen atom or alkyl and the like; A 1 and A 2 are same or different and each represents a single bond or a divalent aliphatic hydrocarbon group; Q represents a single bond, cycloalkylene group, phenylene group or divalent heterocyclic group; R 2A , R 2B , R 2C and R 2D are same or different and each represents a hydrogen atom, alkyl or phenyl; E represents a ethenylene group or —NRCO— (in which R is hydrogen or alkyl) and the like; R 3 represents a phenyl group or a heterocyclic group; R 4 and R 5 are same or different and each represents a hydrogen atom, alkyl, alkoxy, aralkyloxy, halogen, nitro, hydroxy, alkoxycarbonyl, —NR 6 R 7 (in which R 6 and R 7 are same or different and each represents a hydrogen atom or alkyl) and the like.

  提供了一种出色的新型镇痛药，具有对疼痛产生镇痛作用的效果，广泛对抗各种疼痛，包括慢性疼痛或伴随带状疱疹的痛觉过敏，通过作用于一种痛觉素受体。本发明涉及以下式表示的化合物或其盐。在该式中，X和Y相同或不同，每个代表一个氮原子或CH；R1代表一个氢原子或烷基等；A1和A2相同或不同，每个代表一个单键或双价脂肪烃基；Q代表一个单键，环烷基，苯基或双价杂环基；R2A，R2B，R2C和R2D相同或不同，每个代表一个氢原子，烷基或苯基；E代表一个乙烯基或—NRCO—（其中R为氢或烷基）等；R3代表一个苯基或杂环基；R4和R5相同或不同，每个代表一个氢原子，烷基，烷氧基，芳基氧基，卤素，硝基，羟基，烷氧羰基，—NR6R7（其中R6和R7相同或不同，每个代表一个氢原子或烷基）等。