2-<(异丙基氨基)甲基>喹啉 | 105487-97-6

• 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
• 中文名称: 2-<(异丙基氨基)甲基>喹啉
• 英文名称: 2-<(isopropylamino)methyl>quinoline
• 英文别名: N-isopropyl-N-(2-methylquinoline)；N-(quinolin-2-ylmethyl)propan-2-amine
• CAS: 105487-97-6
• 化学式: C₁₃H₁₆N₂
• mdl: MFCD11169310
• 分子量: 200.283
• InChiKey: MRIFOMBSMJBGAB-UHFFFAOYSA-N

物化性质

• 沸点：
  304.3±17.0 °C(Predicted)
• 密度：
  1.044±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.307
• 拓扑面积：
  24.9
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-<(异丙基氨基)甲基>喹啉 、 5,11,17,23-tetrakis(chloromethyl)-25,26,27,28-tetrakis(ethoxyethoxy)calix<4>arene 在 sodium carbonate 作用下， 以 乙腈 为溶剂， 反应 168.0h， 以62%的产率得到5,11,17,23-tetra(methylamine)-N-isopropyl-N-(2-methylquinoline)-25,26,27,28-tetrakis-(2-ethoxyethyl)calix[4]arene
  参考文献：
  名称：

  Calix[4]arenes Linked to Multiple Bidentate N-Donors:  Potential Ligands for Synthetic Modeling of Multinuclear Metalloenzymes

  摘要：

  [GRAPHICS]A series of calix[4]arenes incorporating three or four bidentate diamines or pyridylamines attached at the "upper rim" were synthesized via practical protocols. Proof of structure was obtained in one instance by X-ray crystallography. These molecules are designed for general use as ligands for the preparation of multinuclear active site models of metalloenzymes.

  DOI：

  10.1021/ol025715g
• 作为产物：
  描述：

  喹啉-2-甲醛 、 异丙胺 在 sodium acetoxyborohydride 作用下， 以 乙腈 为溶剂， 反应 0.5h， 以49%的产率得到2-<(异丙基氨基)甲基>喹啉
  参考文献：
  名称：

  Calix[4]arenes Linked to Multiple Bidentate N-Donors:  Potential Ligands for Synthetic Modeling of Multinuclear Metalloenzymes

  摘要：

  [GRAPHICS]A series of calix[4]arenes incorporating three or four bidentate diamines or pyridylamines attached at the "upper rim" were synthesized via practical protocols. Proof of structure was obtained in one instance by X-ray crystallography. These molecules are designed for general use as ligands for the preparation of multinuclear active site models of metalloenzymes.

  DOI：

  10.1021/ol025715g

文献信息

• Synthesis and selective class III antiarrhythmic activity of novel N-heteroaralkyl-substituted 1-(aryloxy)-2-propanolamine and related propylamine derivatives
  作者：John A. Butera、Walter Spinelli、Viji Anantharaman、Nicholas Marcopulos、Roderick W. Parsons、Issam F. Moubarak、Catherine Cullinan、Jehan F. Bagli

  DOI：10.1021/jm00115a010

  日期：1991.11

  The synthesis and biological evaluation of a series of novel 1-(aryloxy)-2-propanolamines and several related deshydroxy analogues are described. Compounds 4-29 were prepared and investigated for their class III electrophysiological activity in isolated canine Purkinje fibers and in anesthetized open-chest dogs. None of these compounds showed any class I activity. On the basis of the in vitro data

  描述了一系列新型的1-（芳氧基）-2-丙醇胺和几种相关的脱羟基类似物的合成和生物学评估。制备了化合物4-29，并在分离的犬浦肯野纤维和麻醉的开胸狗中研究了它们的III类电生理活性。这些化合物均未显示出任何I类活性。基于体外数据，讨论了该系列的结构-活性关系。N- [4- [2-羟基-3- [甲基（2-喹啉基甲基）氨基]丙氧基]苯基]甲磺酰胺（12，WAY-123,223）和N- [2-[[甲基[3- [4]鉴定了[[[（甲基磺酰基）氨基]苯氧基]丙基]氨基]甲基] -6-喹啉基]-甲磺酰胺（24，WAY-125,971），并在体外和体内鉴定为有效的和特定的III类抗心律不齐药物。已发现化合物12具有口服生物利用度，可大幅提高心室纤颤阈值（VFT），并且在某些情况下，以5 mg / kg的剂量在麻醉的开胸狗中可恢复室颤的窦性心律（iv ）。合成了12个对映体（即13和14），并在Purkin
• [EN] PROCESS FOR THE DIASTEREOSELECTIVE PREPARATION OF RUTHENIUM COMPLEXES<br/>[FR] PROCÉDÉ DE PRÉPARATION DIASTÉRÉOSÉLECTIVE DE COMPLEXES DE RUTHÉNIUM
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：WO2014166777A1

  公开（公告）日：2014-10-16

  The present invention relates to a process for the preparation of a compound of formula (I), wherein X is -CH2-, -CH2-CH2-, -CH2-CH2-CH2- or -CH2-CH2-CH2-CH2-; Y1 is -CH2-; -CH2-CH2- or -NH-; Y2 is NHR7 or SH; wherein R7 is hydrogen, C1-C4alkyl or phenyl; R-1 and R2, independently from each other, represent aliphatic or aromatic groups; R3 and R4, independently from each other, represent aliphatic or aromatic groups; R5 and R6 are each hydrogen or represent together with the carbon atoms to which they are bonded, a phenyl ring; which process comprises reacting a compound of formula II [RuCI2(R8)n]m (II), wherein n is 1 and m is > 1 which represents a polymeric structure if R8 is a molecule containing two alkene or alkyne moieties coordinating in an hapto-2 coordination mode to the metal; or n is 4 and m is 1 if R8 is a nitrogen, oxygen or sulfur containing molecule in which said nitrogen, oxygen or sulfur coordinate to the metal; in the presence of an inert solvent which boiling point is from 1 12°C to 165°C with a compound of formula (III), wherein R5, R6, Y1 and Y2 are as defined under formula I, and a phosphane of formula IV R3R4P-X-PR1 R2 (iv), wherein R1, R2, R3, R4 and X are as defined under formula I.

  本发明涉及一种制备式（I）化合物的方法，其中X为-CH2-，-CH2-CH2-，-CH2-CH2-CH2-或-CH2-CH2-CH2-CH2-；Y1为-CH2-，-CH2-CH2-或-NH-；Y2为NHR7或SH；其中R7为氢、C1-C4烷基或苯基；R-1和R2，各自独立地表示脂肪族或芳香族基团；R3和R4，各自独立地表示脂肪族或芳香族基团；R5和R6分别为氢或与它们所连接的碳原子一起表示苯环；该方法包括将式II [RuCI2（R8）n]m（II）的化合物与式III的化合物在惰性溶剂的存在下反应，其中R5，R6，Y1和Y2在式I下定义，并与式IV的膦化合物反应，其中R1，R2，R3，R4和X在式I下定义，其中n为1，m>1，如果R8是含有两个烯烃或炔烃官能团协同配位到金属的分子，则代表聚合结构；如果R8是氮、氧或硫含有分子，则n为4，m为1，其中所述的氮、氧或硫配位到金属上。
• ——
  作者：TAKEHUTI EHJDZI、 KUSASEH YU.、 MAEHDA KUNIYASU、 KIYAMA MINORU

  DOI：——

  日期：——
• PROCESS FOR THE DIASTEREOSELECTIVE PREPARATION OF RUTHENIUM COMPLEXES
  申请人：Syngenta Participations AG

  公开号：EP2984094B1

  公开（公告）日：2020-05-13
• US9303054B2
  申请人：——

  公开号：US9303054B2

  公开（公告）日：2016-04-05