5,6,7,8-Tetrahydro-2-tert.-butylchinolin-8-thiocarboxamid | 53400-90-1

• 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: 5,6,7,8-Tetrahydro-2-tert.-butylchinolin-8-thiocarboxamid
• 英文别名: 2-t-butyl-5,6,7,8-tetrahydroquinoline-8-thiocarboxamide；2-tert-butyl-5,6,7,8-tetrahydro-quinoline-8-carbothioic acid amide；8-Quinolinecarbothioamide, 2-(1,1-dimethylethyl)-5,6,7,8-tetrahydro-；2-tert-butyl-5,6,7,8-tetrahydroquinoline-8-carbothioamide
• CAS: 53400-90-1
• 化学式: C₁₄H₂₀N₂S
• 分子量: 248.392
• InChiKey: VGVJPUVJZCJEAO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  71
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  5,6,7,8-Tetrahydro-2-tert.-butylchinolin-8-carboxamid 以15%的产率得到
  参考文献：
  名称：

  CROSSLEY R.; CURRAN A. C. W.; HILL D. G., J. CHEM. SOC. PERKIN TRANS, PART 1 , 1976, NO 9, 977-982

  摘要：

  DOI：

文献信息

• 8-Carboxylester, and 8-carbamyl derivitives of
  申请人：John Wyeth & Brother Limited

  公开号：US04009169A1

  公开（公告）日：1977-02-22

  The invention relates to novel 5,6,7,8-tetrahydroquinoline derivatives which have a group X situated at the 8-position said group X is CONHR.sup.3, or CO.sub.2 R.sup.5 wherein R.sup.3 is hydrogen lower alkyl and R.sup.5 is hydrogen, lower alkyl or a lower aralkyl radical. The compounds are intermediates for corresponding compounds where X is CSNHR.sup.3 and these are anti-ulcer agents.

  本发明涉及一种新型的5,6,7,8-四氢喹啉衍生物，其在8位具有X基团，所述的X基团为CONHR3或CO2R5，其中R3为氢、低碳基，R5为氢、低碳基或低芳基烷基。这些化合物是相应的X为CSNHR3的化合物的中间体，这些化合物是抗溃疡剂。
• Cyclopenteno[b]pyridine derivatives
  申请人：John Wyeth & Brother Limited

  公开号：US04029668A1

  公开（公告）日：1977-06-14

  The invention relates to novel cyclopenteno[b]pyridine derivatives which have a group X on the 7-position and related tricyclic compounds. X is CONHR.sup.3, or CO.sub.2 R.sup.5 wherein R.sup.3 is hydrogen or lower alkyl and R.sup.5 is hydrogen or a lower alkyl or lower aralkyl group which may be substituted by alkyl, alkoxy, halogen, nitro or trifluoromethyl; other substituents may be present. The compounds are intermediates for compounds wherein X is CSNHR.sup.3 which are anti-ulcer agents.

  本发明涉及一种新颖的环戊烯[b]吡啶衍生物，其在7-位上有一个X基团，以及相关的三环化合物。其中X为CONHR.sup.3或CO.sub.2R.sup.5，其中R.sup.3为氢或低碳基，R.sup.5为氢或低碳基或低芳基碳基，其可被烷基、烷氧基、卤素、硝基或三氟甲基取代；其他取代基也可以存在。这些化合物是X为CSNHR.sup.3的化合物的中间体，后者是抗溃疡剂。
• Certain 5,6,7,8-tetrahydroquinoline-8-thiocarboxamides
  申请人：John Wyeth & Brother Ltd.

  公开号：US04085215A1

  公开（公告）日：1978-04-18

  The invention relates to novel pyridine derivatives which have a fused 5,6, or 7-membered saturated hydrocarbon ring adjacent to the nitrogen of the pyridine ring, and a group X situated on said hydrocarbon ring and separated by one carbon atom from the pyridine nitrogen atom, said group X is cyano, CONHR.sup.3, CSNHR.sup.3 or CO.sub.2 R.sup.5 wherein R.sup.3 is selected from hydrogen, lower alkyl and lower aralkyl radicals and R.sup.5 is selected from hydrogen, lower alkyl and lower aralkyl radicals which may be substituted by alkyl, alkoxy, halogen, nitro or trifluoromethyl; other substituents may be present. Compounds wherein X is CSNHR.sup.3 are anti-ulcer agents and the other compounds are intermediates therefor.

  本发明涉及一种新型吡啶衍生物，其在吡啶环的氮原子相邻处具有融合的5、6或7成员饱和碳氢环，并且在该碳氢环上有一个被分离一个碳原子的X基团，该基团X是氰基、CONHR3、CSNHR3或CO2R5，其中R3选择氢、较低的烷基和较低的芳基烷基基团，R5选择氢、较低的烷基和较低的芳基烷基基团，这些基团可以被烷基、烷氧基、卤素、硝基或三氟甲基取代；其他取代基也可以存在。其中X为CSNHR3的化合物是抗溃疡剂，其他化合物是其中间体。
• Process for preparing pyridine derivatives
  申请人：JOHN WYETH & BROTHER LIMITED

  公开号：EP0054384A1

  公开（公告）日：1982-06-23

  Fused carbocyclic ring derivatives of pyridine which contain a nitrile or thioamide group on the carbocyclic ring e.g. 8-cyano or thiocarboxamido-5,6,7,8-tetrahydro- quinolines are prepared by a process in which a sodium, potassium, lithium or magnesium halide derivative of the pyridine compound is treated with a compound RaRbNCN wherein Ra and Rb are the same or different and represent alkyl, cycloalkyl, or aralkyl, or Ra and Rb are joined to form a heterocyclic ring with the nitrogen, and the product is treated with a proton source to obtain the nitrile which is optionally treated with a sulphurising agent to form the thioamide. The nitriles or thioamides may be isolated as their acid addition salts.

  在碳环上含有腈基或硫酰胺基团的吡啶碳环衍生物，例如8-氰基或硫代羧酰胺基-5,6,7,8-四氢-喹啉的制备方法是：将吡啶化合物的钠、钾、锂或镁卤化物衍生物与化合物 RaRbNCN 一起处理，其中 Ra 和 Rb 可以相同或不同，代表烷基、环烷基或芳烷基，或 Ra 和 Rb 代表环烷基或芳烷基、环烷基或芳烷基，或者 Ra 和 Rb 与氮连接形成杂环，然后用质子源处理产物，得到腈，再用硫化剂处理形成硫代酰胺。腈或硫代酰胺可以作为它们的酸加成盐分离出来。
• US4191761A
  申请人：——

  公开号：US4191761A

  公开（公告）日：1980-03-04