Benzoic acid, 4-[[[2-(1,1-dimethylethyl)phenyl]amino]methyl]- | 833484-97-2

• 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: Benzoic acid, 4-[[[2-(1,1-dimethylethyl)phenyl]amino]methyl]-
• 英文别名: 4-[(2-tert-butylanilino)methyl]benzoic acid
• CAS: 833484-97-2
• 化学式: C₁₈H₂₁NO₂
• 分子量: 283.4
• InChiKey: XPJKDDFAFQNGHW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  3

文献信息

• [EN] BENZOIC AND PHENYL ACETIC ACID DERIVATIVES AS HNF-4 MODULATORS<br/>[FR] DERIVES D'ACIDE BENZOIQUE ET PHENYLACETIQUE UTILISES EN TANT QUE MODULATEURS DES RECEPTEURS DU FACTEUR HNF-4 DOLLAR G(A)
  申请人：LIGAND PHARMACUETICALS INC

  公开号：WO2005009104A2

  公开（公告）日：2005-02-03

  The present invention is directed to hepatocyte nuclear factor 4a (HNF-4a) receptor modulator compounds. This invention is also directed to pharmaceutical compositions containing such compounds as well as methods of using such compounds and pharmaceutical compositions for modulating HNF-4a receptors as well as processes mediated by HNF-4a receptors. Also provided are methods of making such compounds and pharmaceutical compositions, as well as intermediates used in their synthesis.