3-Isopropylsulfanyl-1-phenyl-propan-1-one | 140697-57-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-Isopropylsulfanyl-1-phenyl-propan-1-one
• 英文别名: 1-Phenyl-3-(propan-2-ylsulfanyl)propan-1-one；1-phenyl-3-propan-2-ylsulfanylpropan-1-one
• CAS: 140697-57-0
• 化学式: C₁₂H₁₆OS
• 分子量: 208.324
• InChiKey: NPOXANPLEXKHRA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  14
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  42.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-Isopropylsulfanyl-1-phenyl-propan-1-one 、 亚甲基三苯基膦烷 以 四氢呋喃 为溶剂， 反应 1.0h， 生成 4-(Isopropylthio)-2-phenyl-1-butene
  参考文献：
  名称：

  Photocyclization of 4-(dialkylamino)-2-aryl-1-butenes

  摘要：

  Irradiation of 4-(dialkylamino)-2-aryl-1-butenes gave cyclization products, 3-methyl-3-arylpyrrolidines, in high yields. These styrylamines formed fluorescent intramolecular exciplexes, but studies based on Stern-Volmer quenching for the fluorescence and the photoreaction suggested that the emissive exciplexes did not participate in the photoreaction.

  DOI：

  10.1021/jo00037a017
• 作为产物：
  描述：

  异丙硫醇 、 1-苯基-2-丙烯基-1-酮 在 三乙胺 作用下， 生成 3-Isopropylsulfanyl-1-phenyl-propan-1-one
  参考文献：
  名称：

  Photocyclization of 4-(dialkylamino)-2-aryl-1-butenes

  摘要：

  Irradiation of 4-(dialkylamino)-2-aryl-1-butenes gave cyclization products, 3-methyl-3-arylpyrrolidines, in high yields. These styrylamines formed fluorescent intramolecular exciplexes, but studies based on Stern-Volmer quenching for the fluorescence and the photoreaction suggested that the emissive exciplexes did not participate in the photoreaction.

  DOI：

  10.1021/jo00037a017

文献信息

• POTENT AGELASTATIN DERIVATIVES AS MODULATORS FOR CANCER INVASION AND METASTASIS
  申请人：Massachusetts Institute of Technology

  公开号：US20200062771A1

  公开（公告）日：2020-02-27

  The present disclosure relates to derivatized agelastatin compounds and methods for the treatment, prevention, or delay of cancer, comprising administering a therapeutically effect amount of the derivatized agelastatin compounds, a pharmaceutically acceptable salt thereof, or a composition thereof to a subject in need thereof. Methods for making the derivatized agelastatin compounds are also provided.