4,4'-(6-(1-(2-ethylhexyl)-5-(4-methoxyphenyl)-1H-indol-3-yl)-1,3,5-triazine-2,4-diyl)bis(2-methylbenzene-1,3-diol) | 1236032-09-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 4,4'-(6-(1-(2-ethylhexyl)-5-(4-methoxyphenyl)-1H-indol-3-yl)-1,3,5-triazine-2,4-diyl)bis(2-methylbenzene-1,3-diol)
• 英文别名: 4-[4-(2,4-Dihydroxy-3-methylphenyl)-6-[1-(2-ethylhexyl)-5-(4-methoxyphenyl)indol-3-yl]-1,3,5-triazin-2-yl]-2-methylbenzene-1,3-diol
• CAS: 1236032-09-9
• 化学式: C₄₀H₄₂N₄O₅
• 分子量: 658.797
• InChiKey: VOXXHGROOPZKDX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9
• 重原子数：
  49
• 可旋转键数：
  11
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  134
• 氢给体数：
  4
• 氢受体数：
  8

文献信息

• Bis resorcinyl triazine derivatives as protecting agents against UV radiation
  申请人：ISDIN, S.A.

  公开号：EP2210887A1

  公开（公告）日：2010-07-28

  The present invention relates to new compounds of general formula (I) where R1 is a ring system containing C and N, being at least one of them different from C; optionally being substituted; R2 and R2' are radicals, same or different, independently selected from linear or branched (C1-C4)alkyl, and-O-(C1-C4)alkyl; R3 and R3' are radicals, same or different, independently selected from hydrogen, (C1-C18)acyl radical, linear or branched (C1-C18)alkyl, and linear or branched (C2-C18)alkenyl; wherein the radical is optionally substituted. The physicochemical properties of said compounds allow them to be used as protecting agents against UV radiation.

  本发明涉及一般式为（I）的新化合物，其中R1是含有C和N的环系统，其中至少一个不同于C；可选地被取代；R2和R2'是基团，相同或不同，独立地选自线性或支链（C1-C4）烷基和-O-（C1-C4）烷基；R3和R3'是基团，相同或不同，独立地选自氢、（C1-C18）酰基基团、线性或支链（C1-C18）烷基和线性或支链（C2-C18）烯基；其中该基团可选地被取代。所述化合物的物理化学性质使它们能够用作防护剂来对抗紫外线辐射。
• [EN] BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION<br/>[FR] DÉRIVÉS DE BIS-RÉSORCINYLE-TRIAZINE EN TANT QU'AGENTS DE PROTECTION CONTRE LE RAYONNEMENT ULTRAVIOLET
  申请人：ISDIN SA

  公开号：WO2010081835A2

  公开（公告）日：2010-07-22

  The present invention relates to new compounds of general Formula (I), where R1 is a ring system containing C and N, being at least one of them different from C; optionally being substituted; R2 and R2' are radicals, same or different, independently selected from linear or branched (C1-C4)alkyl, and - O-(C1-C4)alkyl; R3 and R3' are radicals, same or different, independently selected from hydrogen, (C-1-C-18)acyl radical, linear or branched (C-1-C-18)alkyl, and linear or branched (C2-C-18)alkenyl; wherein the radical is optionally substituted. The physicochemical properties of said compounds allow them to be used as protecting agents against UV radiation.