5-Phenyl-4,5-dihydro-isoxazole-3-carboxylic acid (4-chloro-phenyl)-amide | 107402-50-6

• 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: 5-Phenyl-4,5-dihydro-isoxazole-3-carboxylic acid (4-chloro-phenyl)-amide
• 英文别名: N-(4-chlorophenyl)-5-phenyl-4,5-dihydro-1,2-oxazole-3-carboxamide
• CAS: 107402-50-6
• 化学式: C₁₆H₁₃ClN₂O₂
• 分子量: 300.744
• InChiKey: ZRYRIPIABAIVMS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  50.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  苯乙烯 、 N-4-Chlorophenyl-α-methoxycarbonyl-α-nitroacetamide 以 均三甲苯 为溶剂， 反应 10.0h， 以60%的产率得到5-Phenyl-4,5-dihydro-isoxazole-3-carboxylic acid (4-chloro-phenyl)-amide
  参考文献：
  名称：

  Synthesis of Isoxazoline-3-carboxanilides and Isoxazole-3-carboxanilides by Thermolysis of α-Methoxycarbonyl-α-nitroacetanilides in the Presence of Dipolarophiles

  摘要：

  DOI：

  10.1055/s-1986-31684

文献信息

• SHIMIZU TOMIO; HAYASHI YOSHIYUKI; ITO TAKASHI; TERAMURA KAZUHIRO, SYNTHESIS,(1986) N 6, 488-490
  作者：SHIMIZU TOMIO、 HAYASHI YOSHIYUKI、 ITO TAKASHI、 TERAMURA KAZUHIRO

  DOI：——

  日期：——
• SCREENING METHODS FOR SPINAL MUSCULAR ATROPHY
  申请人：Indiana University Research and Technology Corporation

  公开号：US20140193906A1

  公开（公告）日：2014-07-10

  Disclosed herein are compositions and methods for treatment of spinal muscular atrophy (SMA). In certain embodiments, compounds are provided that increase full-length survival of motor neuron (SMN) protein production by an SMN2 gene.
• COMPOUNDS FOR USE IN SCREENING METHODS FOR SPINAL MUSCULAR ATROPHY
  申请人：Indiana University Research and Technology Corporation

  公开号：US20160052935A1

  公开（公告）日：2016-02-25

  Disclosed herein are compositions and methods for treatment of spinal muscular atrophy (SMA). In certain embodiments, compounds are provided that increase full-length survival of motor neuron (SMN) protein production by an SMN2 gene.
• US9212209B2
  申请人：——

  公开号：US9212209B2

  公开（公告）日：2015-12-15