N-[3-(4-chlorophenyl)oxetan-3-yl]-2-methylpropane-2-sulfinamide | 1211284-00-2

• 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: N-[3-(4-chlorophenyl)oxetan-3-yl]-2-methylpropane-2-sulfinamide
• CAS: 1211284-00-2
• 化学式: C₁₃H₁₈ClNO₂S
• 分子量: 287.81
• InChiKey: VXCXLNQSUUUZSM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  57.5
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  4-溴氯苯 、 3-[(叔丁基亚磺酰基)亚氨基]氧杂环丁烷 在 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 1.17h， 以79%的产率得到N-[3-(4-chlorophenyl)oxetan-3-yl]-2-methylpropane-2-sulfinamide
  参考文献：
  名称：

  Reactions of Oxetan-3-tert-butylsulfinimine for the Preparation of Substituted 3-Aminooxetanes

  摘要：

  The oxetane ring is useful in drug discovery as a bioisostere for both the geminal dimethyl group and the carbonyl group. A convenient, straightforward approach to access structurally diverse 3-aminooxetanes through the reactivity of oxetan-3-terf-butylsulfinimine and the corresponding sulfinylaziridine is described.

  DOI：

  10.1021/ol100119e

文献信息

• Highly Functional Group Compatible Rh-Catalyzed Addition of Arylboroxines to Activated <i>N</i>-<i>tert</i>-Butanesulfinyl Ketimines
  作者：Hyung Hoon Jung、Andrew W. Buesking、Jonathan A. Ellman

  DOI：10.1021/ol201438k

  日期：2011.8.5

  The rhodium-catalyzed addition of readily accessible arylboroxines to N-tert-butanesulfinyl ketimines derived from oxetan-3-one, N-Boc-azetidin-3-one, and isatins proceeds In high yields with excellent functional group compatibility. Moreover, high diastereoselectivities are observed for the additions to the N-sulfinyl ketimines derived from isatins.
• Reactions of Oxetan-3-<i>tert</i>-butylsulfinimine for the Preparation of Substituted 3-Aminooxetanes
  作者：Philip J. Hamzik、Jason D. Brubaker

  DOI：10.1021/ol100119e

  日期：2010.3.5

  The oxetane ring is useful in drug discovery as a bioisostere for both the geminal dimethyl group and the carbonyl group. A convenient, straightforward approach to access structurally diverse 3-aminooxetanes through the reactivity of oxetan-3-terf-butylsulfinimine and the corresponding sulfinylaziridine is described.