2,2'-(1-(5-methoxy-1-(methylsulfonyl)indolin-3-yl)hexane-2,6-diyl)diisoindoline-1,3-dione | 1180130-42-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异吲哚及其衍生物
• 英文名称: 2,2'-(1-(5-methoxy-1-(methylsulfonyl)indolin-3-yl)hexane-2,6-diyl)diisoindoline-1,3-dione
• CAS: 1180130-42-0
• 化学式: C₃₂H₃₁N₃O₇S
• 分子量: 601.68
• InChiKey: KGUGEPGZQMKBDP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.08
• 重原子数：
  43.0
• 可旋转键数：
  10.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  121.37
• 氢给体数：
  0.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  2,2'-(1-(5-methoxy-1-(methylsulfonyl)indolin-3-yl)hexane-2,6-diyl)diisoindoline-1,3-dione 在 manganese(IV) oxide 作用下， 以 1,2-二氯乙烷 为溶剂， 反应 4.0h， 以100%的产率得到2,2'-(1-(5-methoxy-1-(methylsulfonyl)-1H-indol-3-yl)pentane-1,5-diyl)diisoindoline-1,3-dione
  参考文献：
  名称：

  Functional Primary Amines and Diamines from α-Aminoacids. A Concise Route to Substituted 2-Aminotetralins

  摘要：

  S-Phthalimidomethyl xanthates derived from various alpha-amino acids add efficiently to a range of unactivated alkenes to give a variety of highly functionalized, protected amines. In the case of phenylalanine and tyrosine derived xanthates, the adducts can be further converted into the rare 4-substituted 2-aminotetralines by a radical ring closure onto the aromatic ring.

  DOI：

  10.1021/ol901263t
• 作为产物：
  描述：

  dithiocarbonic acid S-(3,7-bis-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-1-{[methanesulfonyl-(4-methoxy-phenyl)-amino]-methyl}-heptyl) ester O-ethyl ester 在 过氧化双月桂酰 作用下， 以 1,2-二氯乙烷 为溶剂， 生成 2,2'-(1-(5-methoxy-1-(methylsulfonyl)indolin-3-yl)hexane-2,6-diyl)diisoindoline-1,3-dione
  参考文献：
  名称：

  Functional Primary Amines and Diamines from α-Aminoacids. A Concise Route to Substituted 2-Aminotetralins

  摘要：

  S-Phthalimidomethyl xanthates derived from various alpha-amino acids add efficiently to a range of unactivated alkenes to give a variety of highly functionalized, protected amines. In the case of phenylalanine and tyrosine derived xanthates, the adducts can be further converted into the rare 4-substituted 2-aminotetralines by a radical ring closure onto the aromatic ring.

  DOI：

  10.1021/ol901263t