1-[2-[[2-(4-Chlorophenyl)phenyl]methoxy]ethyl]piperidine;hydrochloride

• 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: 1-[2-[[2-(4-Chlorophenyl)phenyl]methoxy]ethyl]piperidine;hydrochloride
• 英文别名: 1-[2-[[2-(4-chlorophenyl)phenyl]methoxy]ethyl]piperidine;hydrochloride
• 化学式: C20H25Cl2NO
• 分子量: 366.3
• InChiKey: GHZHBWJGFNGTMJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.43
• 重原子数：
  24
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  12.5
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• NEW CRYSTALLINE FORM OF CLOPERASTINE HYDROCHLORIDE
  申请人：SYN-TECH CHEM. & PHARM. CO., LTD.

  公开号：US20140142313A1

  公开（公告）日：2014-05-22

  The present invention provides a compound of new crystalline form I and form II of 1-[2-[(4-chlorophenyl)phenylmethoxy]ethyl]piperidinium monohydrochloride. The compound of form I has an X-ray diffraction pattern expressed in terms of 2-theta angles that comprises the following peaks: 15.5, 15.9, 17.6, 18.3, 18.8, 19.8, 20.2, 20.8, 21.2, 21.9, 22.9, 24.8, 25.7, 27.7, 28.0, and 30.6 degrees. In addition, the compound of form II has an X-ray diffraction pattern expressed in terms of 2-theta angles that comprises the following peaks: 14.8, 16.7, 17.3, 18.0, 18.2, 19.8, 20.5, 21.1, 22.8, 23.7, 25.0, 25.2, 25.4, 26.4, 27.8, 28.3, 29.0, 29.9, and 31.6 degrees.