2,2'-(2,4,6-trimethyl-1,4-dihydropyridine-3,5-diyl)bis(4-(4-chlorophenyl)decahydroquinoline) | 1447968-13-9

• 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: 2,2'-(2,4,6-trimethyl-1,4-dihydropyridine-3,5-diyl)bis(4-(4-chlorophenyl)decahydroquinoline)
• CAS: 1447968-13-9
• 化学式: C₃₈H₄₉Cl₂N₃
• 分子量: 618.733
• InChiKey: BYWCAQAZDJLSJO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.49
• 重原子数：
  43.0
• 可旋转键数：
  4.0
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  36.09
• 氢给体数：
  3.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  3,5-丁二酮-2,4,6-三甲基-1,4-羟基吡啶 在 ammonium acetate 、 sodium ethanolate 、 溶剂黄146 、 potassium hydroxide 作用下， 以 乙醇 为溶剂， 反应 6.0h， 生成 2,2'-(2,4,6-trimethyl-1,4-dihydropyridine-3,5-diyl)bis(4-(4-chlorophenyl)decahydroquinoline)
  参考文献：
  名称：

  Synthesis, antibacterial and antifungal evaluation of novel 1,4-dihydropyridine derivatives

  摘要：

  3,5-Diacetyl-1,4-dihydro-2,4,6-trimethylpyridine (1) has been condensed with aromatic aldehydes to give the corresponding cinnamoyl derivatives IIa-e. the behavior of IIc, d towards thiourea, hydroxylamine hydrochloride, hydrazine hydrate and other bifunctional reagents has been investigated. The newly synthesized compounds were screened for their antimicrobial activity against Gram-positive bacteria, Gram-negative bacteria and as antifungal reagent. Among all the tested compounds, it was found that compounds IIIa and Vila, b revealed better activity against the Gram-positive rather than the Gram-negative bacteria. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.saa.2012.12.069