ethyl 3-acetyl-6-methyl-4-oxoheptanoate | 1082065-90-4

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 酮酸及其衍生物
• 英文名称: ethyl 3-acetyl-6-methyl-4-oxoheptanoate
• 英文别名: 3-acetyl-6-methyl-4-oxoheptanoic acid ethyl ester；3-Acetyl-6-methyl-4-oxoheptanoic acid ethyl ester
• CAS: 1082065-90-4
• 化学式: C₁₂H₂₀O₄
• 分子量: 228.288
• InChiKey: IZLDCDODHFYKNA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  16
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  60.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  ethyl 3-acetyl-6-methyl-4-oxoheptanoate 在 肼 作用下， 生成 ethyl [3-methyl-5-(2-methylpropyl)-1H-pyrazol-4-yl]acetate
  参考文献：
  名称：

  WO2007/141267

  摘要：

  公开号：
• 作为产物：
  描述：

  溴乙酸乙酯 在 氢氧化钾 作用下， 以 1,4-二氧六环 、 水 为溶剂， 反应 0.25h， 生成 ethyl 3-acetyl-6-methyl-4-oxoheptanoate
  参考文献：
  名称：

  WO2007/141267

  摘要：

  公开号：

文献信息

• [EN] COMPOUNDS AND THEIR USE AS INHIBITORS OF N-MYRISTOYL TRANSFERASE<br/>[FR] COMPOSÉS ET LEUR UTILISATION EN TANT QU'INHIBITEURS DE LA N-MYRISTOYL TRANSFÉRASE
  申请人：IMP INNOVATIONS LTD

  公开号：WO2017001812A1

  公开（公告）日：2017-01-05

  This invention provides compounds of formula (I) and salts thereof, which have activity as inhibitors of N-myristoyl transferase (NMT). The invention also relates to uses of such compounds as medicaments, in particular in the treatment of a disease or disorder in which inhibition of N-myristoyl transferase provides a therapeutic or prophylactic effect, including protozoan infections (such as malaria and leishmaniasis), viral infections (such as human rhinovirus and HIV), and hyperproliferative disorders (such as B-cell lymphoma).

  这项发明提供了式（I）的化合物及其盐，具有作为N-肉豆蔻酰转移酶（NMT）抑制剂的活性。该发明还涉及将这类化合物用作药物的用途，特别是在治疗需要抑制N-肉豆蔻酰转移酶以产生治疗或预防效果的疾病或紊乱中，包括原虫感染（如疟疾和利什曼病）、病毒感染（如人类鼻病毒和HIV）以及高增殖性疾病（如B细胞淋巴瘤）。
• 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS
  申请人：Badescu Valentina O.

  公开号：US20100120785A1

  公开（公告）日：2010-05-13

  The present invention provides selective 5-HT 7 receptor antagonist compounds of Formula I and their use in the treatment of migraine, persistent pain, and anxiety: where A and B are each independently C(H)═ or N═, provided that at least one of A and B is —N═, n is 1-3, m is 0-3, and R 14 are as defined herein.

  本发明提供了5-HT7受体拮抗剂化合物I的选择性，并且这些化合物可用于治疗偏头痛、持续性疼痛和焦虑症。其中，A和B各自独立地为C(H)═或N═，但至少有一个A和B是—N═，n为1-3，m为0-3，R14如本文所定义。
• 2-[4-(pyrazol-4-ylalkyl)piperazin-1-yl]-3-phenyl pyrazines as 5-HT7 receptor antagonists
  申请人：Eli Lilly and Company

  公开号：US08202873B2

  公开（公告）日：2012-06-19

  The present invention provides selective 5-HT7 receptor antagonist compounds of Formula I and their use in the treatment of migraine, persistent pain, and anxiety: where A and B are each independently —C(H)═ or —N═, provided that at least one of A and B is —N═, n is 1-3, m is 0-3, and R1-4 are as defined herein.

  本发明提供了式I的选择性5-HT7受体拮抗剂化合物及其在治疗偏头痛、持续性疼痛和焦虑症方面的用途：其中A和B分别独立地为—C(H)═或—N═，但至少其中之一为—N═，n为1-3，m为0-3，R1-4如本文所定义。
• N-(Phenylmethyl)-2-(1H-Pyrazol-4-yl) Acetamide Derivatives as P2X7 Antagonists for the Treatment of Pain, Inflammation and Neurodegeneration
  申请人：Beswick Paul John

  公开号：US20090149524A1

  公开（公告）日：2009-06-11

  The present invention relates to novel pyrazole derivatives of formula (I) which bind to the P2X7 receptor and are capable of interfering with the effects of ATP at the P2X7 receptor: and the use of such compounds or pharmaceutical compositions thereof in the treatment of disorders mediated by the P2X7 receptor, for example pain, inflammation and neurodegeneration.

  本发明涉及一种新的嘧唑衍生物，其化学式为（I），该衍生物与P2X7受体结合，能够干扰ATP在P2X7受体上的作用：以及在治疗由P2X7受体介导的疾病，例如疼痛、炎症和神经退行性方面，使用此类化合物或其制剂的药物组合物。
• Compounds and their use as inhibitors of N-myristoyl transferase
  申请人：Imperial College Innovations Limited

  公开号：US10759804B2

  公开（公告）日：2020-09-01

  This invention provides compounds of formula (I) and salts thereof, which have activity as inhibitors of N-myristoyl transferase (NMT). The invention also relates to uses of such compounds as medicaments, in particular in the treatment of a disease or disorder in which inhibition of N-myristoyl transferase provides a therapeutic or prophylactic effect, including protozoan infections (such as malaria and leishmaniasis), viral infections (such as human rhinovirus and HIV), and hyperproliferative disorders (such as B-cell lymphoma).

  本发明提供了式(I)化合物及其盐类，它们具有作为N-肉豆蔻酰转移酶(NMT)抑制剂的活性。本发明还涉及此类化合物作为药物的用途，特别是在治疗抑制 N-肉豆蔻酰基转移酶可提供治疗或预防效果的疾病或紊乱中的用途，包括原生动物感染（如疟疾和利什曼病）、病毒感染（如人类鼻病毒和 HIV）和过度增殖性紊乱（如 B 细胞淋巴瘤）。