1-Propanone, 3-(dimethylamino)-1-(4-(phenylmethoxy)phenyl)-, hydrochloride | 51345-77-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-Propanone, 3-(dimethylamino)-1-(4-(phenylmethoxy)phenyl)-, hydrochloride
• 英文别名: 3-(dimethylamino)-1-(4-phenylmethoxyphenyl)propan-1-one;hydrochloride
• CAS: 51345-77-8
• 化学式: C18H22ClNO2
• 分子量: 319.8
• InChiKey: JAMXOOWCTJUJQX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.82
• 重原子数：
  22
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  磺胺 、 1-Propanone, 3-(dimethylamino)-1-(4-(phenylmethoxy)phenyl)-, hydrochloride 以 乙醇 、 水 为溶剂， 以35 %的产率得到4-{3-[4-(benzyloxy)phenyl]-3-oxopropyl}aminobenzenesulfonamide
  参考文献：
  名称：

  10.33224/rrch.2024.69.3-4.01

  摘要：

  A synthetic approach to N-[3-(hetero)aryl-3-oxoprop-1-yl]sulfonamides by N-alkylation of sulfanilamide with structurally diverse ketone Mannich base hydrochlorides is being reported. This scarcely explored synthetic strategy that involves aminomethylated ketones as starting materials has afforded novel compounds, potentially useful as inhibitors of carbonic anhydrases, with moderate to good yields.

  DOI：

  10.33224/rrch.2024.69.3-4.01
• 作为产物：
  描述：

  氯化苄 在 盐酸 、 potassium hydroxide 作用下， 以 乙醇 、 水 、 异丙醇 为溶剂， 反应 4.0h， 生成 1-Propanone, 3-(dimethylamino)-1-(4-(phenylmethoxy)phenyl)-, hydrochloride
  参考文献：
  名称：

  10.33224/rrch.2024.69.3-4.01

  摘要：

  A synthetic approach to N-[3-(hetero)aryl-3-oxoprop-1-yl]sulfonamides by N-alkylation of sulfanilamide with structurally diverse ketone Mannich base hydrochlorides is being reported. This scarcely explored synthetic strategy that involves aminomethylated ketones as starting materials has afforded novel compounds, potentially useful as inhibitors of carbonic anhydrases, with moderate to good yields.

  DOI：

  10.33224/rrch.2024.69.3-4.01

文献信息

• 10.33224/rrch.2024.69.3-4.01
  作者：Roman, Gheorghe

  DOI：10.33224/rrch.2024.69.3-4.01

  日期：——

  A synthetic approach to N-[3-(hetero)aryl-3-oxoprop-1-yl]sulfonamides by N-alkylation of sulfanilamide with structurally diverse ketone Mannich base hydrochlorides is being reported. This scarcely explored synthetic strategy that involves aminomethylated ketones as starting materials has afforded novel compounds, potentially useful as inhibitors of carbonic anhydrases, with moderate to good yields.