2-methyl-N-(2-phenylmethoxyethyl)propan-1-amine | 883973-29-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-methyl-N-(2-phenylmethoxyethyl)propan-1-amine
• CAS: 883973-29-3
• 化学式: C₁₃H₂₁NO
• 分子量: 207.316
• InChiKey: ZIONIXYUQJAMDG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  15
• 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：
  21.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-methyl-N-(2-phenylmethoxyethyl)propan-1-amine 在 sodium hydroxide 、 TEA 作用下， 以 甲醇 、 甲苯 为溶剂， 生成 [3-(2-Benzyloxy-ethyl)-3-isobutyl-ureido]-acetic acid
  参考文献：
  名称：

  A novel series of urea-based peptidomimetic calpain inhibitors

  摘要：

  A series of peptide aldehyde derivatives in which the P-2 chiral carbon has been replaced with nitrogen were synthesized as urea-based peptidomimetic inhibitors of mu-calpain. The compounds mirrored the general SAR of peptidyl aldehyde calpain inhibitors but displayed greater selectivity for mu-calpain over cathepsin B. (C) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.12.068
• 作为产物：
  描述：

  苄氧基乙醛 、 异丁胺 在 sodium cyanoborohydride 作用下， 以 甲醇 为溶剂， 生成 2-methyl-N-(2-phenylmethoxyethyl)propan-1-amine
  参考文献：
  名称：

  A novel series of urea-based peptidomimetic calpain inhibitors

  摘要：

  A series of peptide aldehyde derivatives in which the P-2 chiral carbon has been replaced with nitrogen were synthesized as urea-based peptidomimetic inhibitors of mu-calpain. The compounds mirrored the general SAR of peptidyl aldehyde calpain inhibitors but displayed greater selectivity for mu-calpain over cathepsin B. (C) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.12.068

文献信息

• A novel series of urea-based peptidomimetic calpain inhibitors
  作者：M. Lee Sanders、Isaac O. Donkor

  DOI：10.1016/j.bmcl.2005.12.068

  日期：2006.4

  A series of peptide aldehyde derivatives in which the P-2 chiral carbon has been replaced with nitrogen were synthesized as urea-based peptidomimetic inhibitors of mu-calpain. The compounds mirrored the general SAR of peptidyl aldehyde calpain inhibitors but displayed greater selectivity for mu-calpain over cathepsin B. (C) 2006 Elsevier Ltd. All rights reserved.