di[2-(N-methyl-N-t-butylamino)ethyl] disulphide | 227937-36-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: di[2-(N-methyl-N-t-butylamino)ethyl] disulphide
• 英文别名: di[2-(N-methyl-N-t-butylamino)ethyl]disulphide；N-[2-[2-[tert-butyl(methyl)amino]ethyldisulfanyl]ethyl]-N,2-dimethylpropan-2-amine
• CAS: 227937-36-2
• 化学式: C₁₄H₃₂N₂S₂
• 分子量: 292.553
• InChiKey: ZNLUAGUTEMJNRS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  18
• 可旋转键数：
  9
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  57.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  cyclosporin A 、 di[2-(N-methyl-N-t-butylamino)ethyl] disulphide 在 sodium amide 作用下， 以 四氢呋喃 、 氨 为溶剂， 以5%的产率得到(3S,6S,9S,12R,15S,18S,21S,24S,27R,30S,33S)-27-[2-[tert-butyl(methyl)amino]ethylsulfanyl]-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-methyl-hex-4-enyl]-6,9,18,24-tetraisobutyl-3,21-diisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
  参考文献：
  名称：

  Synthesis of non-immunosuppressive cyclophilin-Binding cyclosporin A derivatives as potential anti-HIV-1 drugs

  摘要：

  Original cyclosporin A (CsA) derivatives bearing various alkylthio side chains at the sarcosine residue 3 (R configuration) and for the most potent and selective compounds a 4'-hydroxyl group at the Me-Leucine residue 4 were prepared in one or two steps from commercially available CsA. The [2-(dimethyl or diethylamino)-ethylthio-Sar](3)-[(4'-OH)MeLeu](4)-CsA derivatives 3k and 3l displayed potent in vitro anti-HIV-1 (IC50 similar to 46 nM) and low immunosuppressive activities (IC50 > 1500 nM). (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2003.09.042
• 作为产物：
  描述：

  2-(N-t-butyl-N-methylamino)ethanethiol 在 sodium hydroxide 作用下， 以 甲醇 、 乙醚 为溶剂， 生成 di[2-(N-methyl-N-t-butylamino)ethyl] disulphide
  参考文献：
  名称：

  Cyclosporin compounds, their preparation and the pharmaceutical

  摘要：

  式(I)的环孢霉素化合物：##STR1##其中Alk和R的定义如本文所述，或其药学上可接受的盐，这些衍生物在治疗和/或预防逆转录病毒感染方面是有用的。

  公开号：

  US05994299A1

文献信息

• US5965527A
  申请人：——

  公开号：US5965527A

  公开（公告）日：1999-10-12
• Synthesis of non-immunosuppressive cyclophilin-Binding cyclosporin A derivatives as potential anti-HIV-1 drugs
  作者：Michel Evers、Jean-Claude Barrière、Georges Bashiardes、Anne Bousseau、Jean-Christophe Carry、Norbert Dereu、Bruno Filoche、Yvette Henin、Serge Sablé、Marc Vuilhorgne、Serge Mignani

  DOI：10.1016/j.bmcl.2003.09.042

  日期：2003.12

  Original cyclosporin A (CsA) derivatives bearing various alkylthio side chains at the sarcosine residue 3 (R configuration) and for the most potent and selective compounds a 4'-hydroxyl group at the Me-Leucine residue 4 were prepared in one or two steps from commercially available CsA. The [2-(dimethyl or diethylamino)-ethylthio-Sar](3)-[(4'-OH)MeLeu](4)-CsA derivatives 3k and 3l displayed potent in vitro anti-HIV-1 (IC50 similar to 46 nM) and low immunosuppressive activities (IC50 > 1500 nM). (C) 2003 Elsevier Ltd. All rights reserved.
• Cyclosporin compounds, their preparation and the pharmaceutical
  申请人：Rhone-Poulenc Rorer, S.A.

  公开号：US05965527A1

  公开（公告）日：1999-10-12

  A cyclosporin compound of the formula (I): ##STR1## wherein Alk and R are as defined herein, or a pharmaceutically acceptable salt thereof, which derivatives are is useful in the treatment and/or prophylaxis of retrovirus infections.

  公式（I）的环孢霉素化合物：##STR1## 其中Alk和R如本文所定义，或其药学上可接受的盐，这些衍生物对于治疗和/或预防逆转录病毒感染是有用的。