3-甲氧基-N,2-二甲基苯甲酰胺 | 95330-29-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 3-甲氧基-N,2-二甲基苯甲酰胺
• 英文名称: 3-methoxy-2,N-dimethylbanzamide
• 英文别名: 3-methoxy-2,N-dimethylbenzamide；3-methoxy-2,N-dimethyl-benzamide；3-Methoxy-N,2-dimethylbenzamide
• CAS: 95330-29-3
• 化学式: C₁₀H₁₃NO₂
• 分子量: 179.219
• InChiKey: NGGOXYSBOABHMI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-甲氧基-N,2-二甲基苯甲酰胺 在 lithium aluminium tetrahydride 、 正丁基锂 、 potassium tert-butylate 作用下， 以 乙醚 为溶剂， 反应 10.0h， 生成 (E)-3-methoxy-2-pent-1-enylbenzyl alcohol
  参考文献：
  名称：

  Giles, Robin G. F.; Green, Ivan R.; Pestana, J. Alexandre X., Journal of the Chemical Society. Perkin transactions I, 1984, p. 2389 - 2396

  摘要：

  DOI：
• 作为产物：
  描述：

  3-methoxy-2,N-dimethyl-N-(t-butyl)benzamide 在 三氟乙酸 作用下， 反应 18.0h， 以87%的产率得到3-甲氧基-N,2-二甲基苯甲酰胺
  参考文献：
  名称：

  Giles, Robin G. F.; Green, Ivan R.; Pestana, J. Alexandre X., Journal of the Chemical Society. Perkin transactions I, 1984, p. 2389 - 2396

  摘要：

  DOI：

文献信息

• [EN] UROTENSIN II RECEPTOR MODULATORS<br/>[FR] MODULATEURS DU RECEPTEUR DE L'UROTENSINE II
  申请人：ACADIA PHARM INC

  公开号：WO2003104216A1

  公开（公告）日：2003-12-18

  Disclosed are compounds of Formula I, or salts or prodrugs thereof, complexed with a human urotensin II receptor as defined herein. Also disclosed are compounds of Formula II, or salts or prodrugs thereof, as defined herein. Also disclosed are methods of modulating the activity of a urotensin II receptor using a compound of Formula I, or a compound of Formula II, or salts or prodrugs thereof. In addition, methods of treating diseases related to the activity of urotensin II receptors are disclosed.

  本文披露了根据本文所定义的与人类尿嘧啶 II 受体形成络合物的 Formula I 化合物，或其盐或前药。还披露了根据本文所定义的 Formula II 化合物，或其盐或前药。还披露了使用 Formula I 化合物、Formula II 化合物、或其盐或前药来调节尿嘧啶 II 受体活性的方法。此外，还披露了治疗与尿嘧啶 II 受体活性相关疾病的方法。
• WO2007/16525
  申请人：——

  公开号：——

  公开（公告）日：——
• Isochromanone-based urotensin-II receptor agonists
  作者：Fredrik Lehmann、Erika A. Currier、Roger Olsson、Uli Hacksell、Kristina Luthman

  DOI：10.1016/j.bmc.2005.01.056

  日期：2005.4

  A series of analogues of the selective non-peptide urotensin II (UII) receptor agonist 3-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-isochroman- 1-one (AC-7954, 1) was synthesized and evaluated for UII agonist activity using a functional cell-based assay. The introduction of a methyl group in the 4-position resulted in a complete loss of activity, whereas substituents in the aromatic rings were beneficial. Sterically demanding amino groups were also detrimental to the activity. Several potent agonists were identified, six compounds being equally or more potent than 1. The most potent compound in the series was the 6,7-dimethyl analogue of 1 (16, pEC(50) 6.87). The racemate of 16 was resolved into the pure enantiomers using preparative straight phase HPLC. It was shown that the potency resides in the (+)-enantiomer (pEC(50) 7.11). The synthesized compounds seem to be selective for the UII receptor as no activities were observed at the closely related SSTR3 and 5 receptors. (c) 2005 Elsevier Ltd. All rights reserved.
• GILES, R. G. F.;GREEN, I. R.;PESTANA, J. A. X., J. CHEM. SOC. PERKIN TRANS., 1984, N 10, 2389-2395
  作者：GILES, R. G. F.、GREEN, I. R.、PESTANA, J. A. X.

  DOI：——

  日期：——
• TROPANE COMPOUNDS
  申请人：Exelixis, Inc.

  公开号：EP2074120B1

  公开（公告）日：2010-03-03