1-(1,2-二苯基乙基)哌啶盐酸盐 | 28383-15-5

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 中文名称: 1-(1,2-二苯基乙基)哌啶盐酸盐
• 中文别名: 5,8-亚甲基-1,2,4-甲桥薁,十氢-,(1a,2a,3ab,4a,5a,8a,8ab)-(9CI)
• 英文名称: diphenidine hydrochloride
• 英文别名: (+/-)-1-(1,2-diphenylethyl)piperidine hydrochloride；1-bibenzyl-α-yl-piperidine; hydrochloride；1-Bibenzyl-α-yl-piperidin; Hydrochlorid；dl-1,2-Diphenyl-1-piperidinoethane hydrochloride；1-(1,2-diphenylethyl)piperidine;hydrochloride
• CAS: 28383-15-5
• 化学式: C₁₉H₂₃N*ClH
• 分子量: 301.859
• InChiKey: JVRKIARTCFQTHJ-UHFFFAOYSA-N

物化性质

• 熔点：
  207-209 °C
• 溶解度：
  DMF：50 mg/ml； DMSO：30 mg/ml；乙醇：30 mg/ml； PBS（pH 7.2）：3 mg/ml

计算性质

• 辛醇/水分配系数(LogP)：
  4.88
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  3.2
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2933399090

反应信息

• 作为产物：
  描述：

  1-(1,2-二苯基乙基)哌啶 (2Z)-2-丁烯二酸盐(1:1) 在 盐酸 、 水 作用下， 生成 1-(1,2-二苯基乙基)哌啶盐酸盐
  参考文献：
  名称：

  NMDA receptor affinities of 1,2-diphenylethylamine and 1-(1,2-diphenylethyl)piperidine enantiomers and of related compounds

  摘要：

  We resolved 1,2-diphenylethylamine (DPEA) into its (S)- and (R)- enantiomer and used them as precursors for synthesis of (S)- and (R)-1-(1,2-diphenylethyl)piperidine,flexible homeomorphs of the NMDA channel blocker MK-801. We also describe the synthesis of the dicyclohexyl analogues of DPEA. These and related compounds were tested as inhibitors of [(3)H]MK-801 binding to rat brain membranes. Stereospecificity ranged between factors of 0.5 and 50. Some blockers exhibited stereospecific sensitivity to the modulator spermine. Our results may help to elucidate in more detail the NMDA channel pharmacophore. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2009.03.025

文献信息

• NMDA receptor affinities of 1,2-diphenylethylamine and 1-(1,2-diphenylethyl)piperidine enantiomers and of related compounds
  作者：Michael L. Berger、Anna Schweifer、Patrick Rebernik、Friedrich Hammerschmidt

  DOI：10.1016/j.bmc.2009.03.025

  日期：2009.5

  We resolved 1,2-diphenylethylamine (DPEA) into its (S)- and (R)- enantiomer and used them as precursors for synthesis of (S)- and (R)-1-(1,2-diphenylethyl)piperidine,flexible homeomorphs of the NMDA channel blocker MK-801. We also describe the synthesis of the dicyclohexyl analogues of DPEA. These and related compounds were tested as inhibitors of [(3)H]MK-801 binding to rat brain membranes. Stereospecificity ranged between factors of 0.5 and 50. Some blockers exhibited stereospecific sensitivity to the modulator spermine. Our results may help to elucidate in more detail the NMDA channel pharmacophore. (C) 2009 Elsevier Ltd. All rights reserved.