3-methoxy-N-(2,2-dimethoxyethyl)benzylidenamine

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 3-methoxy-N-(2,2-dimethoxyethyl)benzylidenamine
• 化学式: C₁₂H₁₇NO₃
• 分子量: 223.272
• InChiKey: ISDDMVDVRURZNA-MDWZMJQESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.73
• 重原子数：
  16.0
• 可旋转键数：
  6.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  40.05
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  3-methoxy-N-(2,2-dimethoxyethyl)benzylidenamine 在 硫酸 作用下， 生成 7-甲氧基异喹啉
  参考文献：
  名称：

  Discovery of novel tetrahydroisoquinoline derivatives as potent and selective factor Xa inhibitors

  摘要：

  A series of novel 2,7-disubstituted tetrahydroisoquinoline derivatives were designed and synthesized. Among these derivatives, compounds I and 2 (JTV-803) exhibited potent inhibitory activity against FXa and good selectivity with respect to other serine proteases (thrombin, plasmin, and trypsin). In addition, compound 2 exhibited potent anti-FXa activity after intravenous and oral administration to cynomolgus monkey, and showed a dose-dependent antithrombotic effect in a rat model of venous thrombosis. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.10.033
• 作为产物：
  描述：

  3-甲氧基苯甲醛 、 氨基乙醛缩二甲醇 以 甲苯 为溶剂， 生成 3-methoxy-N-(2,2-dimethoxyethyl)benzylidenamine
  参考文献：
  名称：

  Discovery of novel tetrahydroisoquinoline derivatives as potent and selective factor Xa inhibitors

  摘要：

  A series of novel 2,7-disubstituted tetrahydroisoquinoline derivatives were designed and synthesized. Among these derivatives, compounds I and 2 (JTV-803) exhibited potent inhibitory activity against FXa and good selectivity with respect to other serine proteases (thrombin, plasmin, and trypsin). In addition, compound 2 exhibited potent anti-FXa activity after intravenous and oral administration to cynomolgus monkey, and showed a dose-dependent antithrombotic effect in a rat model of venous thrombosis. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.10.033

文献信息

• Method of producing alpha.sub.2 antagonism
  申请人：Smithkline Corporation

  公开号：US04352809A1

  公开（公告）日：1982-10-05

  Method of producing alpha.sub.2 antagonism by administering thiadiazolo- and oxadiazolotetrahydroisoquinoline compounds.

  通过给予噻二唑和氧二唑四氢异喹啉化合物的方法产生α.sub.2拮抗作用。
• Inhibiting phenylethanolamine N-methyltransferase with thiadiazolo and
  申请人：SmithKline Corporation

  公开号：US04258049A1

  公开（公告）日：1981-03-24

  Thiadiazolo- and oxadiazolotetrahydroisoquinoline compounds are inhibitors of phenylethanolamine N-methyltransferase.

  Thiadiazolo-和oxadiazolotetrahydroisoquinoline化合物是苯乙醇胺N-甲基转移酶的抑制剂。
• Tetrahydroisoquinoline derivatives, process for preparing them and compositions containing them
  申请人：SMITHKLINE BECKMAN CORPORATION

  公开号：EP0023761A1

  公开（公告）日：1981-02-11

  Thiadiazolo- and oxadiazolo-tetrahydroisoquinoline derivatives which are inhibitors of phenylethanolamine N-methyltransferase which catalyzes the final step in the biosynthesis of epinephrine. The compounds of the invention can be prepared by various methods, and in general they will be administered as pharmaceutical compositions.

  噻二唑和噁二唑四氢异喹啉衍生物是苯乙醇胺 N-甲基转移酶的抑制剂，该酶催化肾上腺素生物合成的最后一步。本发明的化合物可以通过各种方法制备，一般来说，它们将作为药物组合物给药。
• HENDRICKSON, J. B.;RODRIGUEZ, C., J. ORG. CHEM., 1983, 48, N 19, 3344-3346
  作者：HENDRICKSON, J. B.、RODRIGUEZ, C.

  DOI：——

  日期：——
• Method of producing alpha2 antagonism
  申请人：SMITHKLINE BECKMAN CORPORATION

  公开号：EP0074741B1

  公开（公告）日：1986-11-12