1-(2-chloro-ethyl)-4-phenyl-piperidine-4-carboxylic acid ethyl ester; hydrochloride | 61532-50-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 1-(2-chloro-ethyl)-4-phenyl-piperidine-4-carboxylic acid ethyl ester; hydrochloride
• 英文别名: 1-(2-Chlor-aethyl)-4-phenyl-piperidin-4-carbonsaeure-aethylester; Hydrochlorid；1-(2-chloroethyl)-4-phenyl-4-piperidinecarboxylic acid ethyl ester hydrochloride；ethyl 1-(2-chloroethyl)-4-phenylpiperidine-4-carboxylate;hydrochloride
• CAS: 61532-50-1
• 化学式: C₁₆H₂₂ClNO₂*ClH
• 分子量: 332.27
• InChiKey: TUVVWQTUGGFVIW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.24
• 重原子数：
  21
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(2-chloro-ethyl)-4-phenyl-piperidine-4-carboxylic acid ethyl ester; hydrochloride 、 苯胺 在 水 、 sodium carbonate 作用下， 生成 乙基4-苯基-1-[2-(苯基氨基)乙基]哌啶-4-羧酸酯
  参考文献：
  名称：

  Strong Analgesics. The Preparation of Some Ethyl 1-Anilinoalkyl-4-Phenylpiperidine-4-Carboxylates

  摘要：

  DOI：

  10.1021/ja01523a073
• 作为产物：
  描述：

  去甲哌替啶 在 氯化亚砜 、 乙酸乙酯 作用下， 生成 1-(2-chloro-ethyl)-4-phenyl-piperidine-4-carboxylic acid ethyl ester; hydrochloride
  参考文献：
  名称：

  Anderson et al., Journal of the Chemical Society, 1956, p. 4088,4090

  摘要：

  DOI：

文献信息

• 1-(3,3,3-Triarylalkyl)-4-phenyl-piperidinealkanols
  申请人：G. D. Searle & Co.

  公开号：US04072686A1

  公开（公告）日：1978-02-07

  The present invention encompasses compounds of the formula ##STR1## and pharmaceutically acceptable acid addition salts thereof wherein the Alk is straight or branched chain alkylene containing 2-4 carbon atoms; M is alkylene having 1-4 carbon atoms; Ar and Ar' are phenyl, alkyl substituted phenyl wherein the alkyl contains from 1-4 carbon atoms or halo substituted phenyl; Ar" is phenyl, alkyl substituted phenyl wherein the alkyl contains 1-4 carbon atoms, halo substituted phenyl or pyridyl; X is hydrogen, halogen, trifluoromethyl or alkyl having from 1-4 carbon atoms; R is hydrogen alkyl having from 1-7 carbon atoms or an alkanoyl having from 2-5 carbon atoms. These compounds are potent antidiarrheal agents characterized by little, if any, central nervous system activity.

  本发明涵盖了式子##STR1##的化合物及其药学上可接受的酸加成盐，其中Alk是直链或支链烷基，含有2-4个碳原子；M是含有1-4个碳原子的烷基；Ar和Ar'是苯基，烷基取代的苯基，其中烷基含有1-4个碳原子或卤代取代的苯基；Ar"是苯基，烷基取代的苯基，其中烷基含有1-4个碳原子，卤代取代的苯基或吡啶基；X是氢，卤素，三氟甲基或含有1-4个碳原子的烷基；R是氢，含有1-7个碳原子的烷基或含有2-5个碳原子的脂肪酰基。这些化合物是具有强效止泻作用的药物，其特点是几乎没有中枢神经系统活性。
• 1-Triarylalkyl-4-phenyl-4-piperidine carboxylic acids and derivatives
  申请人：G. D. Searle & Co.

  公开号：US04066654A1

  公开（公告）日：1978-01-03

  The present invention encompasses compounds of the formula ##STR1## wherein the Alk is straight or branched chain alkylene containing 2-4 carbon atoms; Ar and Ar' are phenyl, Alkyl substituted phenyl wherein the alkyl contains from 1-4 carbon atoms or halo substituted phenyl; Ar" is phenyl, alkyl substituted phenyl wherein the alkyl contains 1-4 carbon atoms, halo substituted phenyl or pyridyl; X is hydrogen, halogen, trifluoromethyl or alkyl having from 1-4 carbon atoms; R is hydrogen, alkyl having from 1-7 carbon atoms, alkenyl having 3-7 carbon atoms, Ar" as herein before defined, or a cation selected from the group consisting of sodium, potassium, ammonium or calcium/2. Compounds of the present invention are potent antidiarrheal agents with little, if any, central nervous system activity.

  本发明涵盖以下式子的化合物：##STR1## 其中Alk是含有2-4个碳原子的直链或支链烷基；Ar和Ar'是苯基、烷基取代苯基（其中烷基含有1-4个碳原子）或卤素取代苯基；Ar"是苯基、烷基取代苯基（其中烷基含有1-4个碳原子）、卤素取代苯基或吡啶基；X是氢、卤素、三氟甲基或含有1-4个碳原子的烷基；R是氢、含有1-7个碳原子的烷基、含有3-7个碳原子的烯基、如上所述的Ar"，或从钠、钾、铵或钙/2所选的阳离子。本发明的化合物是具有强效的止泻作用，几乎没有中枢神经系统活性的药物。
• Anderson et al., Journal of the Chemical Society, 1956, p. 4088,4090
  作者：Anderson et al.

  DOI：——

  日期：——
• Lower alkyl 4-phenyl-1-(substituted-alkyl) piperidine-4-carboxylates and preparationthereof
  申请人：STERLING DRUG INC

  公开号：US02846437A1

  公开（公告）日：1958-08-05
• US4066654A
  申请人：——

  公开号：US4066654A

  公开（公告）日：1978-01-03