4-(3,5-Dibromophenyl)-2,6-diphenyl-1,4-dihydro-1,3,5-triazine

• 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: 4-(3,5-Dibromophenyl)-2,6-diphenyl-1,4-dihydro-1,3,5-triazine
• 英文别名: 4-(3,5-dibromophenyl)-2,6-diphenyl-1,4-dihydro-1,3,5-triazine
• 化学式: C₂₁H₁₅Br₂N₃
• 分子量: 469.2
• InChiKey: OVTAPKAHAHWOQM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  36.8
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• CYCLIC AZINE COMPOUND HAVING NITROGEN-CONTAINING FUSED AROMATIC GROUP, METHOD FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME AS CONSTITUENT COMPONENT
  申请人：Tosoh Corporation

  公开号：EP2778160A1

  公开（公告）日：2014-09-17

  A cyclic azine compound of formula (1): wherein, Y is C-H or a nitrogen atom, Ar1 is a C6-18 aromatic hydrocarbon group, which may be substituted with an C1-4 alkyl group or a phenyl group, Ar2 is a hydrogen atom, or a C6-18 aromatic hydrocarbon group, which may be substituted with a phenyl group or a pyridyl group, or is a nitrogen-containing condensed ring C9-15 aromatic group, Ar3 is a nitrogen-containing condensed ring C9-15 aromatic group, X is a phenylene group, and n is an integer in the range of 0-3. The cyclic azine compound is useful as a constituent of an organic electroluminescent device.

  式（1）的环吖嗪化合物： 其中，Y 是 C-H 原子或氮原子；Ar1 是 C6-18 芳烃基团，可被 C1-4 烷基或苯基取代；Ar2 是氢原子，或 C6-18 芳烃基团，可被苯基或吡啶基取代，或为含氮缩合环 C9-15 芳烃基团；Ar3 是含氮缩合环 C9-15 芳烃基团；X 是亚苯基；n 是 0-3 范围内的整数。环状叠氮化合物可用作有机电致发光器件的成分。