1-Phenyl-5-(2-oxo-1-pyrrolidinyl)-1,2,3-triazoline | 121318-95-4

• 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-Phenyl-5-(2-oxo-1-pyrrolidinyl)-1,2,3-triazoline
• 英文别名: 2-Pyrrolidinone, 1-(4,5-dihydro-1-phenyl-1H-1,2,3-triazol-5-yl)-；1-(3-phenyl-4,5-dihydrotriazol-4-yl)pyrrolidin-2-one
• CAS: 121318-95-4
• 化学式: C₁₂H₁₄N₄O
• 分子量: 230.269
• InChiKey: WENUAYIOWZPCKJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  48.3
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  N-乙烯基吡咯烷酮 、 叠氮苯 以 neat (no solvent) 为溶剂， 反应 720.0h， 以46%的产率得到1-Phenyl-5-(2-oxo-1-pyrrolidinyl)-1,2,3-triazoline
  参考文献：
  名称：

  Triazolines. 25. 1,3-Cycloaddition of aryl azides to enamides and the synthesis of 1-aryl-5-amido-1,2,3-triazolines

  摘要：

  This paper describes for the first tune the 1,3-dipolar cycloaddition of aryl azides to the vinylic bond of enamides, represented by the N-vinyllactam N-vinyl-2-pyrrolidinone (NVP) (Ia) and the open-chain enamide, N-methyl-N-vinylacetamide (NVA) (Ib). Mecharustically, enamides react like enamines in azide cycloaddition reactions to yield 1-aryl-5-amido-1,2,3-triazolines (II).

  DOI：

  10.1021/jo00037a024

文献信息

• Delta2-1,2,3-triazoline anticonvulsants and their active metabolite analogues, the aminoalkylpyridines, are excitatory amino acid antagonists and antiischemic agents, useful in the treatment of cerebral ischemia resulting from stroke
  申请人：K and K Biosciences, Inc.

  公开号：US20040073039A1

  公开（公告）日：2004-04-15

  Pharmaceutical compositions comprise as the active ingredient, nonneurotixic antiischemic compounds that are highly effective by the intraperitoneal route, and that are excitatory amino acid and NMDA/sigma receptor antagonists and are selected from the group consisting of those of the formulae, 1 wherein R 2 is 4-pyridyl, 3-pyridyl, or 2-oxo- 1 -pyrrolidino and R 1 is 3,4- or 3,5-dichloro, p- or m-chloro, p- or m-bromo, p- or m-fluoro, p- or m-trifluoromethyl, p-methyl, p-methoxy, or hydrogen, and those of the formulae, 2 wherein R 2 is 4-pyridyl or 3-pyridyl, R 3 is hydrogen, methyl or ethyl and R 1 is 3,4- or 3,5-dichloro, p- or m-chloro, p- or m-bromo, p- or m-fluoro, p- or m-trifluoromethyl, p-methyl, p-methoxy or hydrogen.

  药物组合物包括非神经毒性抗缺血化合物作为活性成分，通过腹腔注射途径高效，且它们是兴奋性氨基酸和NMDA/sigma受体拮抗剂，并从下列组中选择：1式中R2为4-吡啶基、3-吡啶基或2-氧代-1-吡咯烷基，R1为3,4-或3,5-二氯、对-或间-氯、对-或间-溴、对-或间-氟、对-或间-三氟甲基、对-甲基、对-甲氧基或氢，以及2式中R2为4-吡啶基或3-吡啶基，R3为氢、甲基或乙基，R1为3,4-或3,5-二氯、对-或间-氯、对-或间-溴、对-或间-氟、对-或间-三氟甲基、对-甲基、对-甲氧基或氢。
• KADABA, PANKAJA K.
  作者：KADABA, PANKAJA K.

  DOI：——

  日期：——
• $g(D)?2 ,-1,2,3-TRIAZOLINE ANTICONVULSANTS AND THEIR ACTIVE METABOLITE ANALOGUES, THE AMINOALKYLPYRIDINES, ARE EXCITATORY AMINO ACID ANTAGONISTS AND ANTIISCHEMIC AGENTS, USEFUL IN THE TREATMENT OF CEREBRAL ISCHEMIA RESULTING FROM STROKE
  申请人：K and K Biosciences, Inc.

  公开号：EP1343497A1

  公开（公告）日：2003-09-17
• EP1343497A4
  申请人：——

  公开号：EP1343497A4

  公开（公告）日：2005-01-26
• US4820721A
  申请人：——

  公开号：US4820721A

  公开（公告）日：1989-04-11