1-(2',6'-dichlorophenyl)-2-(2',3'-bis-methoxycarbonyl)guanidino ethanol | 71576-09-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-(2',6'-dichlorophenyl)-2-(2',3'-bis-methoxycarbonyl)guanidino ethanol
• 英文别名: 1-(2',6'-Dichlorophenyl)-2-(2',3'-bismethoxycarbonylguanidino) ethanol；methyl N-[N'-[2-(2,6-dichlorophenyl)-2-hydroxyethyl]-N-methoxycarbonylcarbamimidoyl]carbamate
• CAS: 71576-09-5
• 化学式: C₁₃H₁₅Cl₂N₃O₅
• 分子量: 364.185
• InChiKey: VNWDCTFMGOFXBO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  23
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  109
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  1-(2',6'-dichlorophenyl)-2-(2',3'-bis-methoxycarbonyl)guanidino ethanol 在 sodium hydroxide 、 三乙胺 作用下， 以 甲醇 、 二氯甲烷 、 水 为溶剂， 生成 4-(2,6-dichlorophenyl)-4,5-dihydro-2-methoxycarbonylaminoimidazole
  参考文献：
  名称：

  Method for preparing 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic

  摘要：

  本发明公开了一种制备4,5-二氢-2-烷氧羰基氨基-5-环烷基芳基咪唑及其取代芳基衍生物的方法。通过将式为##STR1##其中R为C.sub.1至C.sub.6线性或支链烷基，R'为苯基，可选地取代为甲二氧基基团或至少一个羟基，卤素，三氟甲基，C.sub.1至C.sub.6线性或支链烷氧基，1-萘基或2-萘基，X为卤素，甲磺氧基或对甲苯磺酸氧基，与一种质子溶剂溶液或分散剂的碱金属或碱土金属氢氧化物，碳酸盐或烷氧基化物进行处理来制备这些化合物。本发明还公开了1-(可选取代的环烷基)-2-(烷氧羰基胍基)乙烷，其通过将上述双烷氧羰基胍基乙烷与无水溶剂的碱金属或碱土金属氢氧化物，碳酸盐或烷氧基化物的溶液或分散剂进行处理而制备。这些化合物在治疗或缓解与中枢神经系统有关的哺乳动物的异常情况方面作为心理治疗剂是有用的。

  公开号：

  US04172204A1

文献信息

• Certain 1-(carbocyclic aryl)-1-halo(or mesyloxy or
  申请人：Syntex (U.S.A.) Inc.

  公开号：US04224224A1

  公开（公告）日：1980-09-23

  A method for preparing 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic aryl imidazoles and substituted aryl derivatives thereof is disclosed. The compounds are prepared by treating a 1-(carbocyclic aryl)-2-(2',3'-bis-carboalkoxyguanidino) ethane of the formula ##STR1## where R is C.sub.1 to C.sub.6 linear or branched alkyl, R' is phenyl optionally substituted with the radial methylenedioxy or at least one hydroxy, halo, trifluoromethyl, C.sub.1 to C.sub.6 linear or branched alkoxy, or 1-naphthyl or 2-naphthyl and X is halo, mesyloxy or tosyloxy with a protic solvent solution or dispersion of an alkali metal or alkaline earth metal hydroxide, carbonate or alkoxide. 1-(Optionally substituted carbocyclic aryl)-2-(carboalkoxyguanidino) ethanes are also disclosed herein, such prepared by treating the above bis-carboalkoxyguanadino ethane with an aprotic solvent solution or dispersion of an alkali metal or alkaline earth metal hydroxide, carbonate or alkoxide. These compounds are useful as psychotherapeutic agents in treating or palliating abnormal conditions, in mammals, which are related to the central nervous system.

  本发明公开了一种制备4,5-二氢-2-烷氧羰基氨基-5-环烷基芳基咪唑及其取代芳基衍生物的方法。该化合物是通过将式为##STR1##的1-(环烷基芳基)-2-(2',3'-双烷氧基胍基)乙烷与质子溶剂溶液或分散的碱金属或碱土金属氢氧化物、碳酸盐或醇盐反应制备而成，其中R为C.sub.1到C.sub.6的直链或支链烷基，R'为苯基，可选地取代为放射状的甲氧基或至少一个羟基、卤素、三氟甲基、C.sub.1到C.sub.6的直链或支链烷氧基、1-萘基或2-萘基，X为卤素、mesyloxy或tosyloxy。本发明还公开了1-(可选取代的环烷基芳基)-2-(烷氧羰基胍基)乙烷，其是通过将上述双烷氧基胍基乙烷与无质子溶剂溶液或分散的碱金属或碱土金属氢氧化物、碳酸盐或醇盐反应制备而成。这些化合物在治疗或缓解与中枢神经系统相关的哺乳动物异常情况方面可用作精神治疗剂。
• 1-Carbocyclic aryl-2-mono or -bis(alkoxycarbonyl) guanidino ethanes, and methods for their preparation and the preparation therefrom of 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic aryl imidazoles
  申请人：SYNTEX (U.S.A.) INC.

  公开号：EP0001500A1

  公开（公告）日：1979-04-18

  A method for preparing 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic aryl imidazoles and substituted aryl derivatives thereof is disclosed. The compounds are prepared by treating a 1-(carbocyclic aryl)-2-(2',3-bis-carbo- alkoxy)guanidino ethane of the formula where R is C, to C. linear or branched alkyl, R' is phenyl optionally substituted with the radical methylenedioxy or at least one hydroxy, halo, trifluoromethyl, C1 to C6 linear or branched alkoxy. C, to C6 linear or branched alkyl; or 1-naphthyl or 2-naphthyl; and X is halo, mesyloxy or tosyloxy; with a protic solvent solution or dispersion of an alkali metal or alkaline earth metal hydroxide, carbonate or alkoxide. The reaction can alternatively be carried out on the corresponding (3'-mono-carboalkoxy)guanidino ethanes. These latter compounds can be prepared by treating the above bis(carboalkoxy)guanidino ethanes with an aprotic solvent solution or dispersion of an alkali metal or alkaline earth metal hydroxide, carbonate or alkoxide. These mono (carboalkoxy)guanidino ethanes are useful as psychotherapeutic agents in treating or palliating abnormal conditions, in mammals, which are relating to the central nervous system.

  本发明公开了一种制备 4,5-二氢-2-烷氧基羰基氨基-5-碳环芳基咪唑及其取代芳基衍生物的方法。这些化合物的制备方法是将式中的 1-(碳环芳基)-2-(2',3-双羧基烷氧基)胍基乙烷 其中 R 是 C,至 C.直链或支链烷基，R'是任选被基团亚甲基二氧基或至少一个羟基、卤代、三氟甲基、C1 至 C6 直链或支链烷氧基取代的苯基。C1-C6直链或支链烷基；或 1-萘基或 2-萘基；X 为卤代、间氧基或对氧基；与碱金属或碱土金属氢氧化物、碳酸盐或氧化碱的原生溶剂溶液或分散液反应。该反应也可以在相应的（3'-单羧基烷氧基）胍基乙烷上进行。这些后一种化合物可以通过用碱金属或碱土金属氢氧化物、碳酸盐或氧化碱的无相溶 剂溶液或分散液处理上述双（羧基烷氧基）胍基乙烷来制备。这些单(羧烷氧基)胍基乙烷可用作精神治疗剂，用于治疗或缓解哺乳动物中与中枢神经系统有关的异常状况。
• US4172204A
  申请人：——

  公开号：US4172204A

  公开（公告）日：1979-10-23
• US4224224A
  申请人：——

  公开号：US4224224A

  公开（公告）日：1980-09-23
• Method for preparing 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic
  申请人：Syntex (U.S.A.) Inc.

  公开号：US04172204A1

  公开（公告）日：1979-10-23

  A method for preparing 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic aryl imidazoles and substituted aryl derivatives thereof is disclosed. The compounds are prepared by treating a 1-(carbocyclic aryl)-2-(2',3'-bis-carboalkoxyguanidino) ethane of the formula ##STR1## where R is C.sub.1 to C.sub.6 linear or branched alkyl, R' is phenyl optionally substituted with the radical methylenedioxy or at least one hydroxy, halo, trifluoromethyl, C.sub.1 to C.sub.6 linear or branched alkoxy, or 1-naphthyl or 2-naphthyl and X is halo, mesyloxy or tosyloxy with a protic solvent solution or dispersion of an alkali metal or alkaline earth metal hydroxide, carbonate or alkoxide. 1-(Optionally substituted carbocyclic aryl)-2-(carboalkoxyguanidino) ethanes are also disclosed herein, such prepared by treating the above bis-carboalkoxyguanadino ethane with an aprotic solvent solution or dispersion of an alkali metal or alkaline earth metal hydroxide, carbonate or alkoxide. These compounds are useful as psychotherapeutic agents in treating or palliating abnormal conditions, in mammals, which are related to the central nervous system.

  本发明公开了一种制备4,5-二氢-2-烷氧羰基氨基-5-环烷基芳基咪唑及其取代芳基衍生物的方法。通过将式为##STR1##其中R为C.sub.1至C.sub.6线性或支链烷基，R'为苯基，可选地取代为甲二氧基基团或至少一个羟基，卤素，三氟甲基，C.sub.1至C.sub.6线性或支链烷氧基，1-萘基或2-萘基，X为卤素，甲磺氧基或对甲苯磺酸氧基，与一种质子溶剂溶液或分散剂的碱金属或碱土金属氢氧化物，碳酸盐或烷氧基化物进行处理来制备这些化合物。本发明还公开了1-(可选取代的环烷基)-2-(烷氧羰基胍基)乙烷，其通过将上述双烷氧羰基胍基乙烷与无水溶剂的碱金属或碱土金属氢氧化物，碳酸盐或烷氧基化物的溶液或分散剂进行处理而制备。这些化合物在治疗或缓解与中枢神经系统有关的哺乳动物的异常情况方面作为心理治疗剂是有用的。