3-imino-N,2-dimethylbutan-1-amine

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 3-imino-N,2-dimethylbutan-1-amine
• 化学式: C₆H₁₄N₂
• 分子量: 114.19
• InChiKey: UJGUJRMAYVENBB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.1
• 重原子数：
  8
• 可旋转键数：
  3
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  35.9
• 氢给体数：
  2
• 氢受体数：
  2

文献信息

• HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES
  申请人：Elanco Tiergesundheit AG

  公开号：EP3452460B1

  公开（公告）日：2020-02-12
• ANTI-TUMOR COMPOUND AND THE MEDICAL USE THEREOF
  申请人：Tianjin Medical University Cancer Institute and Hospital

  公开号：US20170273933A1

  公开（公告）日：2017-09-28

  The invention disclose a compound of formula (I), wherein, R 1 is selected from —H or C1-C6 hydrocarbon group, —NH 2 , —OH, —O(CH 2 ) n CH 3 (n=0, 1 or 2), —N(CH 3 ) 2 , or —CH 2 N(CH 3 ) 2 , R 2 is selected from an amino acid or an hydroxy acid or —OH (R 1 , R 2 are not —CH 3 and —OH at the same time), wherein X, Y are —H, —CH 3 , —CH 2 OH, —CH(OH)CH 3 , —CH 2 SH, —CH(CH 3 ) 2 , —CH 2 CH(CH 3 ) 2 , —CH(CH 3 )CH 2 CH 3 , —CH 2 CH 2 SCH 3 , —CH 2 COOH, —CH 2 CONH 2 , —CH 2 CH 2 COOH, —CH 2 CH 2 CH 2 CH 2 NH 2 , or —CH 2 CH 2 CONH 2 , R 3 -R 5 are H or C1-C6 hydrocarbon group. The compound has a low toxicity, can significantly inhibit the migration and invasion of tumor cells in vitro, and can inhibit tumor metastasis in vivo in mice at low concentration, while showing notable sensitizing effect on cytotoxic anti-tumor drugs such as Paclitaxel etc.