3-methyl-5-N,5-N-dipropyl-2-N-(2,4,6-trimethylphenyl)quinoline-2,5-diamine | 1387636-64-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 3-methyl-5-N,5-N-dipropyl-2-N-(2,4,6-trimethylphenyl)quinoline-2,5-diamine
• CAS: 1387636-64-7
• 化学式: C₂₅H₃₃N₃
• 分子量: 375.557
• InChiKey: RBYNVYWHUQMOGA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.4
• 重原子数：
  28
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  28.2
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-氯-3-甲基喹啉 在 2-methylpyridine borane complex 、 硫酸 、 palladium on activated charcoal 、 氢气 、 硝酸 、 溶剂黄146 作用下， 以 N-甲基吡咯烷酮 、 甲醇 、 乙酸乙酯 为溶剂， 生成 3-methyl-5-N,5-N-dipropyl-2-N-(2,4,6-trimethylphenyl)quinoline-2,5-diamine
  参考文献：
  名称：

  Design, synthesis and structure–activity relationships of 5-alkylaminolquinolines as a novel series of CRF1 receptor antagonists

  摘要：

  A series of 5-alkylaminolquinolines was designed and synthesized as potential novel CRF1 receptor antagonists. The structure-activity relationships (SARs) of the substituents on each position (R-2, R-3, R-5 and R-5') were investigated. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.05.066

文献信息

• Design, synthesis and structure–activity relationships of 5-alkylaminolquinolines as a novel series of CRF1 receptor antagonists
  作者：Kunitoshi Takeda、Taro Terauchi、Kogyoku Shin、Mitsuhiro Ino、Hisashi Shibata、Masahiro Yonaga

  DOI：10.1016/j.bmcl.2012.05.066

  日期：2012.7

  A series of 5-alkylaminolquinolines was designed and synthesized as potential novel CRF1 receptor antagonists. The structure-activity relationships (SARs) of the substituents on each position (R-2, R-3, R-5 and R-5') were investigated. (C) 2012 Elsevier Ltd. All rights reserved.