2-ethylamine hydrochloride | 50376-82-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-ethylamine hydrochloride
• 英文别名: 2-[bis(4-fluorophenyl)methoxy]ethanamine hydrochloride；2-[bis(p-fluorophenyl)methoxy]ethylamine hydrochloride；Ethanamine, 2-[bis(4-fluorophenyl)methoxy]-, hydrochloride；2-[bis(4-fluorophenyl)methoxy]ethanamine;hydrochloride
• CAS: 50376-82-4
• 化学式: C₁₅H₁₅F₂NO*ClH
• 分子量: 299.748
• InChiKey: CKYHSWCXRPLMJA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.68
• 重原子数：
  20
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  36.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-三氟甲基苯丙酮 、 2-ethylamine hydrochloride 在 sodium cyanoborohydride 作用下， 以 甲醇 为溶剂， 反应 24.0h， 生成 VUF9061
  参考文献：
  名称：

  New prenylamine-analogues: investigations of their influence on calcium-dependent biological systems

  摘要：

  Chemically, prenylamine belongs to the diphenylalkylamine class. Compounds of this class are calcium antagonists with a broad spectrum of activities due to their influence on both extracellular and intracellular sites. In the present study the calcium antagonistic profile of a recently developed new series of prenylamine analogues has been investigated using different in vitro systems. The inhibiting concentrations for the most active compound are almost-equal-to 1.5 muM; several derivatives are inactive up to a concentration of 10 muM. Structural modifications towards an increase of lipophilicity make these molecules interact (inhibition) with the intracellular calcium-binding protein calmodulin; for the series no correlation between calcium-blocking and calmodulin antagonistic effects has been found.

  DOI：

  10.1016/0223-5234(93)90086-t

文献信息

• Benzhydryl derivatives having calmodulin inhibitor properties
  申请人：AKZO N.V.

  公开号：US05171752A1

  公开（公告）日：1992-12-15

  The invention relates to a benzhydryl derivative having the formula ##STR1## wherein each of the groups R.sub.1, R.sub.2, and R.sub.3 represents one to four substituents independently selected from the group consisting of hydrogen, lower alkyl, halogen, and CF.sub.3, and at least one of the groups R.sub.1, R.sub.2, and R.sub.3 is halogen or CF.sub.3 ; R.sub.4 represents hydrogen or methyl; n is 2, 3, or 4; m is 1, 2, or 3; and X represents O or S; or its pharmaceutically acceptable salts. The benzhydryl derivative of the invention can be used to treat patients who are suffering from diseases which are influenced by calmodulin.

  本发明涉及一种苯甲酰基衍生物，其化学式为##STR1## 其中，R.sub.1、R.sub.2和R.sub.3中的每个基团都表示从氢、低级烷基、卤素和CF.sub.3中独立选择的1-4个取代基，且R.sub.1、R.sub.2和R.sub.3中至少有一个基团是卤素或CF.sub.3；R.sub.4表示氢或甲基；n为2、3或4；m为1、2或3；X表示O或S；或其药学上可接受的盐。本发明的苯甲酰基衍生物可用于治疗受钙调蛋白影响的疾病患者。
• US5171752A
  申请人：——

  公开号：US5171752A

  公开（公告）日：1992-12-15
• New prenylamine-analogues: investigations of their influence on calcium-dependent biological systems
  作者：P Caldirola、P Zandberg、R Mannhold、H Timmerman

  DOI：10.1016/0223-5234(93)90086-t

  日期：1993.1

  Chemically, prenylamine belongs to the diphenylalkylamine class. Compounds of this class are calcium antagonists with a broad spectrum of activities due to their influence on both extracellular and intracellular sites. In the present study the calcium antagonistic profile of a recently developed new series of prenylamine analogues has been investigated using different in vitro systems. The inhibiting concentrations for the most active compound are almost-equal-to 1.5 muM; several derivatives are inactive up to a concentration of 10 muM. Structural modifications towards an increase of lipophilicity make these molecules interact (inhibition) with the intracellular calcium-binding protein calmodulin; for the series no correlation between calcium-blocking and calmodulin antagonistic effects has been found.