2-tert-Butylamino-1-(4-methoxy-phenyl)-propan-1-one | 735220-83-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-tert-Butylamino-1-(4-methoxy-phenyl)-propan-1-one
• 英文别名: 2-(Tert-butylamino)-1-(4-methoxyphenyl)propan-1-one
• CAS: 735220-83-4
• 化学式: C₁₄H₂₁NO₂
• 分子量: 235.326
• InChiKey: SIBIIMRRABFTJI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  17
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-tert-Butylamino-1-(4-methoxy-phenyl)-propan-1-one 在 sodium tetrahydroborate 作用下， 以 乙醇 为溶剂， 生成 2-tert-Butylamino-1-(4-methoxy-phenyl)-propan-1-ol
  参考文献：
  名称：

  Synthesis and evaluation of the anticonvulsant activity of a series of 2-amino-1-phenyl-1-propanols derived from the metabolites of the antidepressant bupropion

  摘要：

  A series of 2-amino-1-phenyl-1-propanols that are structurally related to known metabolites of bupropion,1 (Wellbutrin(R)) were synthesized and evaluated as potential anticonvulsants. The (R*,R*)-2-tert-butylamino-1-(3-trifluoromethylphenyl) propanol 20 had an ED(50) of 16.5 +/- 2.8 mg/kg ip in mice in the maximal electroshock screen and was chosen for further evaluation. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00577-x
• 作为产物：
  描述：

  大茴香酸 在 ammonium hydroxide 、 氯化亚砜 、 溴 作用下， 以 乙醇 为溶剂， 生成 2-tert-Butylamino-1-(4-methoxy-phenyl)-propan-1-one
  参考文献：
  名称：

  Synthesis and evaluation of the anticonvulsant activity of a series of 2-amino-1-phenyl-1-propanols derived from the metabolites of the antidepressant bupropion

  摘要：

  A series of 2-amino-1-phenyl-1-propanols that are structurally related to known metabolites of bupropion,1 (Wellbutrin(R)) were synthesized and evaluated as potential anticonvulsants. The (R*,R*)-2-tert-butylamino-1-(3-trifluoromethylphenyl) propanol 20 had an ED(50) of 16.5 +/- 2.8 mg/kg ip in mice in the maximal electroshock screen and was chosen for further evaluation. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00577-x

文献信息

• New unlabelled and radioactive labelled derivatives of butylamino propiophenone, their preparation, immunogens obtained from the unlabelled derivatives and a process for immunogen preparation, antisera raised using the immunogens and a method for raising antisera, a radioimmunoassay method and a test kit for use in the assay method
  申请人：THE WELLCOME FOUNDATION LIMITED

  公开号：EP0038071B1

  公开（公告）日：1984-11-14
• US4347176A
  申请人：——

  公开号：US4347176A

  公开（公告）日：1982-08-31
• US4347178A
  申请人：——

  公开号：US4347178A

  公开（公告）日：1982-08-31
• US4347382A
  申请人：——

  公开号：US4347382A

  公开（公告）日：1982-08-31
• US4356165A
  申请人：——

  公开号：US4356165A

  公开（公告）日：1982-10-26