[2-(4-Chloromethyl-phenoxymethoxy)-ethyl]-trimethyl-silane | 178059-03-5

• 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: [2-(4-Chloromethyl-phenoxymethoxy)-ethyl]-trimethyl-silane
• 英文别名: (2-{[4-(Chloromethyl)phenoxy]methoxy}ethyl)(trimethyl)silane；2-[[4-(chloromethyl)phenoxy]methoxy]ethyl-trimethylsilane
• CAS: 178059-03-5
• 化学式: C₁₃H₂₁ClO₂Si
• 分子量: 272.847
• InChiKey: CKARINSYDABYHR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.12
• 重原子数：
  17
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  [2-(4-Chloromethyl-phenoxymethoxy)-ethyl]-trimethyl-silane 、 对羟基苯甲酸甲酯 以to give methyl 4-(2-trimethylsilanylethoxymethyl)-benzoate的产率得到Methyl 4-(2-trimethylsilanylethoxymethyl)-benzoate
  参考文献：
  名称：

  Piperidine derivative having renin inhibiting activity

  摘要：

  本发明涉及哌啶衍生物的制备和用作药物。该发明涉及一般式I的哌啶衍生物，其中R.sup.1，R.sup.2，R.sup.3，R.sup.4，Q，X，Z，m和n如本文所述。

  公开号：

  US06150526A1

文献信息

• Synthesis and antiviral activity of P1′ arylsulfonamide azacyclic urea HIV protease inhibitors
  作者：Peggy P Huang、John T Randolph、Larry L Klein、Sudthida Vasavanonda、Tatyana Dekhtyar、Vincent S Stoll、Dale J Kempf

  DOI：10.1016/j.bmcl.2004.05.036

  日期：2004.8

  A series of novel azacyclic urea HIV protease inhibitors bearing a benzenesulfonamide group at P1' were synthesized utilizing a parallel synthesis method. Structural studies of early analogs bound in the enzyme active site were used to design more potent inhibitors. The effects of substituting the P1' benzenesulfonyl group on antiviral activity and protein binding are described.

  使用平行合成方法合成了一系列在P1'处带有苯磺酰胺基团的新型氮杂环尿素HIV蛋白酶抑制剂。结合在酶活性位点上的早期类似物的结构研究被用于设计更有效的抑制剂。描述了取代P1'苯磺酰基对抗病毒活性和蛋白质结合的影响。
• Piperidine derivatives having renin inhibiting activity
  申请人：Hoffmann-La Roche Inc.

  公开号：US06051712A1

  公开（公告）日：2000-04-18

  Novel piperidine derivatives, their manufacture and use as medicaments, are disclosed. The invention is concerned with the novel piperidine derivatives of general formula I ##STR1## wherein R.sup.1, R.sup.2, R.sup.3, R.sup.4, Q, X, Z, m and n are as described herein.

  本发明涉及新型哌啶衍生物的制备和用作药物。本发明涉及一般式I的新型哌啶衍生物，其中R.sup.1，R.sup.2，R.sup.3，R.sup.4，Q，X，Z，m和n如本文所述。
• Piperidine derivative having renin inhibiting activity
  申请人：Hoffmann-La Roche Inc.

  公开号：US06150526A1

  公开（公告）日：2000-11-21

  Piperidine derivatives, their manufacture and use as medicaments, are disclosed. The invention is concerned with the piperidine derivatives of general formula I ##STR1## wherein R.sup.1, R.sup.2, R.sup.3, R.sup.4, Q, X, Z, m and n are as described herein.

  本发明涉及哌啶衍生物的制备和用作药物。该发明涉及一般式I的哌啶衍生物，其中R.sup.1，R.sup.2，R.sup.3，R.sup.4，Q，X，Z，m和n如本文所述。
• A Novel, Picomolar Inhibitor of Human Immunodeficiency Virus Type 1 Protease
  作者：Hing L. Sham、Chen Zhao、Kent D. Stewart、David A. Betebenner、Shuqun Lin、Chang H. Park、Xiang-P. Kong、William Rosenbrook、Thomas Herrin、Darold Madigan、Suthida Vasavanonda、Nicholas Lyons、Akhter Molla、Ayda Saldivar、Kennan C. Marsh、Edith McDonald、Norman E. Wideburg、Jon F. Denissen、Terrel Robins、Dale J. Kempf、Jacob J. Plattner、Daniel W. Norbeck

  DOI：10.1021/jm9507183

  日期：1996.1.1

  The design, synthesis, and molecular modeling studies of a novel series of azacyclic ureas, which are inhibitors of human immunodeficiency virus type 1 (HIV-1) protease that incorporate different ligands for the S1', S2, and S2' substrate-binding sites of HIV-1 protease are described. The synthesis of this series is highly flexible in the sense that the P1', P2, and P2' residues of the inhibitors can be changed independently. Molecular modeling studies on the phenyl ring of the P2 and P2' ligand suggested incorporation of hydrogen-bonding donor/acceptor groups at the 3' and 4-positions of the phenyl ring should increase binding potency. This led to the discovery of compound 7f (A-98881), which possesses high potency in the HIV-1 protease inhibition assay and the in vitro MT-4 cell culture assay (Ki = approximately 5 pM and EC50 = 0.002 microM). This compares well with the symmetrical cyclic urea 1 pioneered at DuPont Merck.
• Methods of treating alzheimer's disease
  申请人：Nieman A. James

  公开号：US20060079533A1

  公开（公告）日：2006-04-13

  Disclosed are methods for treating Alzheimer's disease, and other diseases, and/or inhibiting beta-secretase enzyme, and/or inhibiting deposition of A beta peptide in a mammal, by use of 3,4-disubstituted piperidinyl compounds of formula (I) wherein the variables R 1 , R 2 , R 3 , R 4 , Q, W, X, Z, m, and n are defined herein.

  本发明公开了一种治疗阿尔茨海默病和其他疾病、抑制β-分泌酶酶和/或抑制哺乳动物中A beta肽沉积的方法，使用式(I)的3,4-二取代哌啶基化合物，其中变量R1、R2、R3、R4、Q、W、X、Z、m和n在此定义。