Methyl (decyldisulfanyl)acetate | 674806-35-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: Methyl (decyldisulfanyl)acetate
• 英文别名: methyl 2-(decyldisulfanyl)acetate
• CAS: 674806-35-0
• 化学式: C₁₃H₂₆O₂S₂
• 分子量: 278.48
• InChiKey: KRUDPCWKECYDKG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  17
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  76.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  Methyl (decyldisulfanyl)acetate 在 二异丁基氢化铝 作用下， 以 乙醚 为溶剂， 反应 2.0h， 生成 Decyldisulfanyl-acetaldehyde
  参考文献：
  名称：

  Vancomycin disulfide derivatives as antibacterial agents

  摘要：

  A series of lipidated vancomycin analogues 1 bearing disulfide bonds within their lipid chains was designed and synthesized to optimize their ADME profiles while retaining antibacterial potency. These compounds exhibited good activity against resistant organisms and low accumulation in tissues such as kidney and liver. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2003.11.040
• 作为产物：
  描述：

  1-癸硫醇 、 巯基乙酸甲酯 在 偶氮二甲酸二乙酯 作用下， 以 二氯甲烷 为溶剂， 反应 13.5h， 生成 Methyl (decyldisulfanyl)acetate
  参考文献：
  名称：

  Vancomycin disulfide derivatives as antibacterial agents

  摘要：

  A series of lipidated vancomycin analogues 1 bearing disulfide bonds within their lipid chains was designed and synthesized to optimize their ADME profiles while retaining antibacterial potency. These compounds exhibited good activity against resistant organisms and low accumulation in tissues such as kidney and liver. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2003.11.040

文献信息

• Vancomycin disulfide derivatives as antibacterial agents
  作者：YongQi Mu、Matthew Nodwell、John L. Pace、Jeng-Pyng Shaw、J.Kevin Judice

  DOI：10.1016/j.bmcl.2003.11.040

  日期：2004.2

  A series of lipidated vancomycin analogues 1 bearing disulfide bonds within their lipid chains was designed and synthesized to optimize their ADME profiles while retaining antibacterial potency. These compounds exhibited good activity against resistant organisms and low accumulation in tissues such as kidney and liver. (C) 2003 Elsevier Ltd. All rights reserved.