N-(2,4-dimethylphenyl)-4,4-dimethyl-5-methylidene-N-prop-2-enyl-1,3-thiazol-2-amine

• 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: N-(2,4-dimethylphenyl)-4,4-dimethyl-5-methylidene-N-prop-2-enyl-1,3-thiazol-2-amine
• 化学式: C₁₇H₂₂N₂S
• 分子量: 286.4
• InChiKey: HWTRVBUZHYXFGP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  40.9
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• Whitening Agent And Skin External Preparation
  申请人：Hanyu Naoto

  公开号：US20100324096A1

  公开（公告）日：2010-12-23

  The present invention provides a compound having an excellent inhibitory action on melanin production and being useful as a whitening agent, and a skin external preparation containing the compound. The whitening agent of the present invention comprises, as an active ingredient, a heterocyclic compound represented by formula (1) or a pharmacologically acceptable salt thereof: wherein A is C 1-6 alkyl, C 5-6 cycloalkyl, benzyl, benzylcarbonyl, benzoyl, phenyl, pyridyl or pyrimidyl; Ra is H, C 1-6 alkyl, or C 2-6 alkenyl; “ ” represents a single bond or a double bond wherein n=1 or 2; Y is S or O; and R 3 and R 4 are each independently H, C 1-6 alkyl, hydroxy-C 1-6 alkyl, C 2-7 acyl, phenyl, pyridyl, pyrimidyl, etc.;with the proviso that at least one R 3 is a group other than C 1-3 alkyl in the case where: the hetero ring containing Y is a thiazoline ring; R 4 ═Ra═H; X 1 ═X 2 ═CH; and either p =0 or R 5 ═C 1-6 alkyl.

  本发明提供了一种具有优异的抑制黑色素生成作用并且可用作美白剂的化合物，以及含有该化合物的皮肤外用制剂。本发明的美白剂包含以下异构化合物作为活性成分：式（1）或其药学上可接受的盐，其中，A是C1-6烷基、C5-6环烷基、苄基、苯甲酰基、苯甲酰基、苯基、吡啶基或嘧啶基；Ra是氢、C1-6烷基或C2-6烯基；“”表示单键或双键，其中n=1或2；Y是S或O；R3和R4分别独立地是氢、C1-6烷基、羟基-C1-6烷基、C2-7酰基、苯基、吡啶基、嘧啶基等；但当：异杂环含有Y是噻唑环；R4═Ra═H；X1═X2═CH；且p=0或R5═C1-6烷基时，至少一个R3是除了C1-3烷基以外的基团。