4-(hydroxymethyl)-N-[2-[4-[2-(phosphanylidynemethoxy)phenyl]piperazin-1-yl]ethyl]-N-pyridin-2-ylcyclohexane-1-carboxamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 4-(hydroxymethyl)-N-[2-[4-[2-(phosphanylidynemethoxy)phenyl]piperazin-1-yl]ethyl]-N-pyridin-2-ylcyclohexane-1-carboxamide
• 化学式: C₂₆H₃₃N₄O₃P
• 分子量: 480.5
• InChiKey: WBHUBFOBGNYPMF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  34
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  69.1
• 氢给体数：
  1
• 氢受体数：
  6

文献信息

• 5HT1A ANTAGONIST USEFUL FOR IN VIVO IMAGING
  申请人：Newington Ian Martin

  公开号：US20140140928A1

  公开（公告）日：2014-05-22

  The present invention provides a novel compound of formula (I) useful for in vivo imaging of 5-HT 1 A receptors in a subject. Also provided by the present invention is a precursor compound useful in the preparation of the compound of the invention, as well as said method of preparation. The present invention additionally provides methods for the use of the compound of the invention in an in vivo imaging method, and use of that in vivo imaging method in diagnosis and therapy monitoring.

  本发明提供了一种新的化合物（I）的公式，用于在受试者中体内成像5-HT1A 受体。本发明还提供了一种前体化合物，用于制备本发明的化合物，以及制备方法。本发明还提供了使用该化合物的方法，用于体内成像方法，并将该体内成像方法用于诊断和治疗监测。
• NOVEL SYNTHESIS METHOD
  申请人：GE HEALTHCARE LIMITED

  公开号：US20150133663A1

  公开（公告）日：2015-05-14

  The present invention relates to a method of making compounds having affinity for the 1 A subtype of the serotonin receptor, i.e. 5HT 1A . The method of the present invention provides advantages over the known methods of synthesis. The compounds obtained by the method of the invention have use in therapeutic methods. The compounds of the invention may also optionally compose a moiety suitable for detection by an in vivo imaging procedure and as such these compounds have use in in vivo imaging methods. The compounds have particular use in the treatment and diagnosis of various neurological and/or psychiatric disorders.

  本发明涉及一种制备具有亲和力的化合物的方法，该化合物对于5HT1A即血清素受体的1A亚型具有亲和力。本发明的方法相对于已知的合成方法具有优势。通过本发明的方法获得的化合物在治疗方法中有用。本发明的化合物也可以选择性地组成适合通过体内成像程序检测的基团，因此这些化合物在体内成像方法中有用。这些化合物在治疗和诊断各种神经和/或精神障碍方面具有特殊用途。