Benzyl 4-[[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]methyl]piperidine-1-carboxylate | 220032-18-8

• 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: Benzyl 4-[[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]methyl]piperidine-1-carboxylate
• CAS: 220032-18-8
• 化学式: C₂₇H₃₅ClN₄O₄
• 分子量: 515.052
• InChiKey: MPNSHBDSGIVCBM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  36
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.48
• 拓扑面积：
  97.1
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  Benzyl 4-[[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]methyl]piperidine-1-carboxylate 在 甲烷磺酸 、 苯甲醚 作用下， 以 氯仿 为溶剂， 反应 3.0h， 生成 4-amino-5-chloro-2-methoxy-N-[1-(4-piperidinylmethyl)-4-piperidinyl]benzamide
  参考文献：
  名称：

  Novel N -[1-(1-substituted 4-piperidinylmethyl)-4-piperidinyl]benzamides as potent colonic prokinetic agents

  摘要：

  A series of novel N-[1-(1-substituted 4-piperidinylmethyl)-4-piperidinyl]benzamides was prepared and its compounds were evaluated for their binding to 5-HT4 receptors and effects on gastrointestinal motility in conscious dogs. 4-Amino-N-[1-[l-(4aminobutyl)-4-piperidinylmethyi]-4-piperidinyl]-5-chloro-2-methoxybenzamide (15) was found to have a potent binding affinity for 5-HT4 receptors (IC50: 6.47 nM) and showed excellent colonic prokinetic activity. (C) 2002 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(02)00060-4
• 作为产物：
  描述：

  4-哌啶甲酸 在 盐酸 、 氯化亚砜 、 硼烷 、 1-(3-二甲基氨基丙基)-3-乙基碳二亚胺 、 三乙胺 作用下， 以 四氢呋喃 、 乙醇 、 二氯甲烷 为溶剂， 反应 37.0h， 生成 Benzyl 4-[[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]methyl]piperidine-1-carboxylate
  参考文献：
  名称：

  Novel N -[1-(1-substituted 4-piperidinylmethyl)-4-piperidinyl]benzamides as potent colonic prokinetic agents

  摘要：

  A series of novel N-[1-(1-substituted 4-piperidinylmethyl)-4-piperidinyl]benzamides was prepared and its compounds were evaluated for their binding to 5-HT4 receptors and effects on gastrointestinal motility in conscious dogs. 4-Amino-N-[1-[l-(4aminobutyl)-4-piperidinylmethyi]-4-piperidinyl]-5-chloro-2-methoxybenzamide (15) was found to have a potent binding affinity for 5-HT4 receptors (IC50: 6.47 nM) and showed excellent colonic prokinetic activity. (C) 2002 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(02)00060-4

文献信息

• 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS
  申请人：Dainippon Pharmaceutical Co., Ltd.

  公开号：EP1076055B1

  公开（公告）日：2004-11-24
• US6294555B1
  申请人：——

  公开号：US6294555B1

  公开（公告）日：2001-09-25
• Novel N -[1-(1-substituted 4-piperidinylmethyl)-4-piperidinyl]benzamides as potent colonic prokinetic agents
  作者：Hiroshi Harada、Hiroshi Yamazaki、Yoshihito Toyotomi、Hirotaka Tateishi、Yukiko Mine、Naoyuki Yoshida、Shiro Kato

  DOI：10.1016/s0960-894x(02)00060-4

  日期：2002.3

  A series of novel N-[1-(1-substituted 4-piperidinylmethyl)-4-piperidinyl]benzamides was prepared and its compounds were evaluated for their binding to 5-HT4 receptors and effects on gastrointestinal motility in conscious dogs. 4-Amino-N-[1-[l-(4aminobutyl)-4-piperidinylmethyi]-4-piperidinyl]-5-chloro-2-methoxybenzamide (15) was found to have a potent binding affinity for 5-HT4 receptors (IC50: 6.47 nM) and showed excellent colonic prokinetic activity. (C) 2002 Published by Elsevier Science Ltd.