S-phenyl 2-methyl-1-aziridinecarbothioate | 22039-86-7

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: S-phenyl 2-methyl-1-aziridinecarbothioate
• 英文别名: 2-methyl-aziridine-1-carbothioic acid S-phenyl ester；1-Phenylthiocarbonyl-2-methylaziridin；S-phenyl 2-methylaziridine-1-carbothioate
• CAS: 22039-86-7
• 化学式: C₁₀H₁₁NOS
• 分子量: 193.269
• InChiKey: SLIRNKHKFFTWJW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  45.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  苯基氯硫代甲酸酯 、 2-甲基氮丙啶 在 三乙胺 作用下， 以 乙醚 为溶剂， 反应 1.0h， 以89%的产率得到S-phenyl 2-methyl-1-aziridinecarbothioate
  参考文献：
  名称：

  Synthesis and antineoplastic activity of 1a-formyl and 1a-thioformyl derivatives of mitomycin C and 2-methylaziridine

  摘要：

  A select number of 1-formyl- and 1-thioformyl-2-methylaziridine derivatives and the corresponding 1a-substituted mitomycin C analogues were synthesized and tested for antineoplastic activity by using an in vivo test with murine P388 leukemia. Select compounds were also tested in vivo with murine melanoma B16. Several of the mitomycin C derivatives displayed activity and some of the mitomycin C analogues were comparable in activity to the parent compound.

  DOI：

  10.1021/jm00393a015

文献信息

• FISHBEIN, PAUL L.;KOHN, HAROLD, J. MED. CHEM., 30,(1987) N 10, 1767-1773
  作者：FISHBEIN, PAUL L.、KOHN, HAROLD

  DOI：——

  日期：——
• Synthesis and antineoplastic activity of 1a-formyl and 1a-thioformyl derivatives of mitomycin C and 2-methylaziridine
  作者：Paul L. Fishbein、Harold Kohn

  DOI：10.1021/jm00393a015

  日期：1987.10

  A select number of 1-formyl- and 1-thioformyl-2-methylaziridine derivatives and the corresponding 1a-substituted mitomycin C analogues were synthesized and tested for antineoplastic activity by using an in vivo test with murine P388 leukemia. Select compounds were also tested in vivo with murine melanoma B16. Several of the mitomycin C derivatives displayed activity and some of the mitomycin C analogues were comparable in activity to the parent compound.