3-(2-氯苯基)-丙酰胺 | 887577-18-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 3-(2-氯苯基)-丙酰胺
• 英文名称: 3-(2-chlorophenyl)-propionamidine
• 英文别名: 3-(2-Chlorophenyl)propanimidamide
• CAS: 887577-18-6
• 化学式: C₉H₁₁ClN₂
• mdl: MFCD06656687
• 分子量: 182.653
• InChiKey: YDHCDDLSQBSZGS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  12
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.222
• 拓扑面积：
  49.9
• 氢给体数：
  2
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  3-(2-氯苯基)-丙酰胺 、 丙二酸二乙酯 在 sodium ethanolate 作用下， 以 乙醇 为溶剂， 生成
  参考文献：
  名称：

  Design and synthesis of piperazinylpyrimidinones as novel selective 5-HT2C agonists

  摘要：

  This Letter reports the design and synthesis of several novel series of piperazinyl pyrimidinones as 5-HT2C agonists. Several of the compounds presented exhibit good in vitro potency and selectivity over the closely related 5-HT2A and 5-HT2B receptors. Compound 11 was active in in vivo models of stress urinary incontinence. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.07.133

文献信息

• Design and synthesis of piperazinylpyrimidinones as novel selective 5-HT2C agonists
  作者：Mark D. Andrews、Martin P. Green、Charlotte M.N. Allerton、David V. Batchelor、Julian Blagg、Alan D. Brown、David W. Gordon、Gordon McMurray、Daniel J. Millns、Carly L. Nichols、Lesa Watson

  DOI：10.1016/j.bmcl.2009.07.133

  日期：2009.9

  This Letter reports the design and synthesis of several novel series of piperazinyl pyrimidinones as 5-HT2C agonists. Several of the compounds presented exhibit good in vitro potency and selectivity over the closely related 5-HT2A and 5-HT2B receptors. Compound 11 was active in in vivo models of stress urinary incontinence. (C) 2009 Elsevier Ltd. All rights reserved.