1-(1-(2,2-dimethylchroman-6-yl)non-2-ynyl)piperidine | 1253582-76-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: 1-(1-(2,2-dimethylchroman-6-yl)non-2-ynyl)piperidine
• 英文别名: 1-[1-(2,2-Dimethyl-3,4-dihydrochromen-6-yl)non-2-ynyl]piperidine；1-[1-(2,2-dimethyl-3,4-dihydrochromen-6-yl)non-2-ynyl]piperidine
• CAS: 1253582-76-1
• 化学式: C₂₅H₃₇NO
• 分子量: 367.575
• InChiKey: WPCDCGVOUALWLK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  27
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  12.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  天然橡胶 在 磷酸 、 zinc(II) acetate dihydrate 作用下， 以 甲苯 、 Petroleum ether 为溶剂， 反应 7.0h， 生成 1-(1-(2,2-dimethylchroman-6-yl)non-2-ynyl)piperidine
  参考文献：
  名称：

  Search of antimycobacterial activities in hybrid molecules with benzopyran skeleton

  摘要：

  A series of hybrid molecules (7-9, 12, 13, and 14-18) consisting of chromans and pyrolidines or cyclic amines were prepared either by (3 + 2) cycloaddition of nitrostyrenes and azomethine ylide or by three component reactions of chromanyl aldehydes, acetylenes, and cyclic amines. All the synthesized compounds were evaluated against both avirulent (H37Ra) and virulent (H37Rv) strains of Mycobacterium tuberculosis. Out of all the compounds screened, compounds 16, 17, and 18 were found to be active against the virulent strain M. tubercolosis H37Rv displaying MIC in the range of 6.25-1.56 mu g/ml against.

  DOI：

  10.1007/s00044-010-9402-6

文献信息

• Search of antimycobacterial activities in hybrid molecules with benzopyran skeleton
  作者：Rama P. Tripathi、Surendra Singh Bisht、Vivek Parashar Pandey、Sarvesh K. Pandey、Shubhra Singh、Sudhir Kumar Sinha、Vinita Chaturvedi

  DOI：10.1007/s00044-010-9402-6

  日期：2011.12

  A series of hybrid molecules (7-9, 12, 13, and 14-18) consisting of chromans and pyrolidines or cyclic amines were prepared either by (3 + 2) cycloaddition of nitrostyrenes and azomethine ylide or by three component reactions of chromanyl aldehydes, acetylenes, and cyclic amines. All the synthesized compounds were evaluated against both avirulent (H37Ra) and virulent (H37Rv) strains of Mycobacterium tuberculosis. Out of all the compounds screened, compounds 16, 17, and 18 were found to be active against the virulent strain M. tubercolosis H37Rv displaying MIC in the range of 6.25-1.56 mu g/ml against.