4-(p-tolyloxy)-2-methylnitrobenzene | 467456-84-4

• 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-(p-tolyloxy)-2-methylnitrobenzene
• 英文别名: 2-Methyl-1-nitro-4-(p-tolyloxy)benzene；2-methyl-4-(4-methylphenoxy)-1-nitrobenzene
• CAS: 467456-84-4
• 化学式: C₁₄H₁₃NO₃
• 分子量: 243.262
• InChiKey: AGCNCURAHXMWOO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  55
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-(p-tolyloxy)-2-methylnitrobenzene 在 盐酸 、 tin(ll) chloride 作用下， 以 乙醇 为溶剂， 反应 2.0h， 生成 2-methyl-4-(4-methylphenoxy)-aniline
  参考文献：
  名称：

  Discovery and structure–activity study of a novel benzoxaborole anti-inflammatory agent (AN2728) for the potential topical treatment of psoriasis and atopic dermatitis

  摘要：

  A series of phenoxy benzoxaboroles were synthesized and screened for their inhibitory activity against PDE4 and cytokine release. 5-(4-Cyanophenoxy)-2,3-dihydro-1-hydroxy-2,1-benzoxaborole (AN2728) showed potent activity both in vitro and in vivo. This compound is now in clinical development for the topical treatment of psoriasis and being pursued for the topical treatment of atopic dermatitis. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.03.007
• 作为产物：
  描述：

  对甲酚 、 5-氟-2-硝基甲苯 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 4-(p-tolyloxy)-2-methylnitrobenzene
  参考文献：
  名称：

  Discovery and structure–activity study of a novel benzoxaborole anti-inflammatory agent (AN2728) for the potential topical treatment of psoriasis and atopic dermatitis

  摘要：

  A series of phenoxy benzoxaboroles were synthesized and screened for their inhibitory activity against PDE4 and cytokine release. 5-(4-Cyanophenoxy)-2,3-dihydro-1-hydroxy-2,1-benzoxaborole (AN2728) showed potent activity both in vitro and in vivo. This compound is now in clinical development for the topical treatment of psoriasis and being pursued for the topical treatment of atopic dermatitis. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.03.007

文献信息

• N-(2-arylethyl) benzylamines as antagonists of the 5-ht6 receptor
  申请人：Chen Zhaogen

  公开号：US20060009511A9

  公开（公告）日：2006-01-12

  The present invention provides compounds of formula (I), which are antagonists of the 5-HT 6 receptor.

  本发明提供了式(I)的化合物，它们是5-HT6受体的拮抗剂。
• N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR
  申请人：Chen Zhaogen

  公开号：US20090306110A1

  公开（公告）日：2009-12-10

  The present invention provides compounds of formula (I), which are antagonists of the 5-HT 6 receptor.

  本发明提供了式（I）的化合物，它们是5-HT6受体的拮抗剂。
• N-(2-ARYLETHYL) BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR
  申请人：ELI LILLY AND COMPANY

  公开号：EP1859798B1

  公开（公告）日：2015-12-30
• US7157488B2
  申请人：——

  公开号：US7157488B2

  公开（公告）日：2007-01-02
• US8044090B2
  申请人：——

  公开号：US8044090B2

  公开（公告）日：2011-10-25