N-{2-[(2-chlorobenzyl)oxy]-3-methoxybenzyl}-4H-1,2,4-triazol-3-amine

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: N-{2-[(2-chlorobenzyl)oxy]-3-methoxybenzyl}-4H-1,2,4-triazol-3-amine
• 英文别名: N-[[2-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]-1H-1,2,4-triazol-5-amine
• 化学式: C₁₇H₁₇ClN₄O₂
• 分子量: 344.8
• InChiKey: MQOPGNOSGQXZJD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  24
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  72.1
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• [EN] AMINOTRIAZOLE- AND AMINOTETRAZOLE-BASED KDM1A INHIBITORS AS EPIGENETIC MODULATORS<br/>[FR] INHIBITEURS DE KDM1A À BASE D'AMINOTROAZOLE ET D'AMINOTÉTRAZOLE COMME MODULATEURS ÉPIGÉNÉTIQUES
  申请人：MUSC FOUND FOR RES DEV

  公开号：WO2015120281A1

  公开（公告）日：2015-08-13

  In some aspects, the present invention provides compounds of the formula (IV), wherein the variables are as defined herein, which may be used as inhibitors of histone demethylase or spermine oxidase. Also provided herein are pharmaceutical compositions of the compounds and methods using the compounds in the treatment of diseases such as cancer and cardiovascular disease.

  本发明在某些方面提供了式（IV）的化合物，其中变量如本文所定义，可用作组蛋白去甲基化酶或精胺氧化酶的抑制剂。本文还提供了这些化合物的药物组合物和使用这些化合物治疗癌症和心血管疾病等疾病的方法。
• AMINOTRIAZOLE- AND AMINOTETRAZOLE-BASED KDM1A INHIBITORS AS EPIGENETIC MODULATORS
  申请人：MUSC FOUNDATION FOR RESEARCH DEVELOPMENT

  公开号：US20170001968A1

  公开（公告）日：2017-01-05

  In some aspects, the present invention provides compounds of the formula (IV), wherein the variables are as defined herein, which may be used as inhibitors of histone demethylase or spermine oxidase. Also provided herein are pharmaceutical compositions of the compounds and methods using the compounds in the treatment of diseases such as cancer and cardiovascular disease.