4-叔丁基-1-环己烷卡巴肼 | 438531-50-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 中文名称: 4-叔丁基-1-环己烷卡巴肼
• 中文别名: 4-(2-甲基-2-丙基)环己烷甲酰肼；4-叔丁基环已烷卡巴肼；4-叔丁基环已烷-1-卡巴肼
• 英文名称: 4-(tert-butyl)cyclohexanecarbohydrazide
• 英文别名: 4-Tert-butylcyclohexanecarbohydrazide；4-tert-butylcyclohexane-1-carbohydrazide
• CAS: 438531-50-1
• 化学式: C₁₁H₂₂N₂O
• mdl: MFCD02055941
• 分子量: 198.308
• InChiKey: KIKKVHHEACDWSX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.909
• 拓扑面积：
  55.1
• 氢给体数：
  2
• 氢受体数：
  2

安全信息

• 海关编码：
  2928000090

反应信息

• 作为反应物：
  描述：

  4-叔丁基-1-环己烷卡巴肼 在 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 、 N,N-二异丙基乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 6.0h， 生成 5-(4-(tert-butyl)cyclohexyl)-N-(7-methoxy-1H-benzo[d]imidazol -2-yl)-1,3,4-oxadiazol-2-amine
  参考文献：
  名称：

  [EN] IMIDAZOPYRIDINE AND OXAZOLOPYRIDINE DERIVATIVES AND ANALOGS THEREOF, METHODS OF PREPARATION THEREOF, METHODS OF HIF-1/2A PATHWAY INHIBITION, AND INDUCTION OF FERROPTOSIS
  [FR] DÉRIVÉS D'IMIDAZOPYRIDINE ET D'OXAZOLOPYRIDINE ET LEURS ANALOGUES, LEURS PROCÉDÉS DE PRÉPARATION, PROCÉDÉS D'INHIBITION DE LA VOIE HIF-1/2A ET INDUCTION DE LA FERROPTOSE

  摘要：

  Novel substituted imidazopyridine and oxazolopyridine compounds that are useful as inhibitors of HIF-1α and HIF-2α and inducers of ferroptosis through perturbations in iron metabolism, synthetic methods for making said compounds, pharmaceutical compositions comprising the compounds, and methods of using the compounds and compositions to treat disorders associated with dysfunction of HIF-1/2α or iron metabolism.

  公开号：

  WO2023234970A1
• 作为产物：
  描述：

  tert-butyl 2-(4-(tert-butyl)cyclohexanecarbonyl)hydrazinecarboxylate 在 盐酸 作用下， 以 乙酸乙酯 为溶剂， 以91.5%的产率得到4-叔丁基-1-环己烷卡巴肼
  参考文献：
  名称：

  [EN] IMIDAZOPYRIDINE AND OXAZOLOPYRIDINE DERIVATIVES AND ANALOGS THEREOF, METHODS OF PREPARATION THEREOF, METHODS OF HIF-1/2A PATHWAY INHIBITION, AND INDUCTION OF FERROPTOSIS
  [FR] DÉRIVÉS D'IMIDAZOPYRIDINE ET D'OXAZOLOPYRIDINE ET LEURS ANALOGUES, LEURS PROCÉDÉS DE PRÉPARATION, PROCÉDÉS D'INHIBITION DE LA VOIE HIF-1/2A ET INDUCTION DE LA FERROPTOSE

  摘要：

  Novel substituted imidazopyridine and oxazolopyridine compounds that are useful as inhibitors of HIF-1α and HIF-2α and inducers of ferroptosis through perturbations in iron metabolism, synthetic methods for making said compounds, pharmaceutical compositions comprising the compounds, and methods of using the compounds and compositions to treat disorders associated with dysfunction of HIF-1/2α or iron metabolism.

  公开号：

  WO2023234970A1

文献信息

• [EN] IMIDAZOPYRIDINE AND OXAZOLOPYRIDINE DERIVATIVES AND ANALOGS THEREOF, METHODS OF PREPARATION THEREOF, METHODS OF HIF-1/2A PATHWAY INHIBITION, AND INDUCTION OF FERROPTOSIS<br/>[FR] DÉRIVÉS D'IMIDAZOPYRIDINE ET D'OXAZOLOPYRIDINE ET LEURS ANALOGUES, LEURS PROCÉDÉS DE PRÉPARATION, PROCÉDÉS D'INHIBITION DE LA VOIE HIF-1/2A ET INDUCTION DE LA FERROPTOSE
  申请人：[en]KUDA THERAPEUTICS, INC.

  公开号：WO2023234970A1

  公开（公告）日：2023-12-07

  Novel substituted imidazopyridine and oxazolopyridine compounds that are useful as inhibitors of HIF-1α and HIF-2α and inducers of ferroptosis through perturbations in iron metabolism, synthetic methods for making said compounds, pharmaceutical compositions comprising the compounds, and methods of using the compounds and compositions to treat disorders associated with dysfunction of HIF-1/2α or iron metabolism.