O-phenyl [2-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]heptyl]sulfanylmethanethioate

• 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: O-phenyl [2-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]heptyl]sulfanylmethanethioate
• 化学式: C₁₉H₂₉NO₄S₂
• 分子量: 399.6
• InChiKey: GKGXMOMAYNKXBF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  26
• 可旋转键数：
  12
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  125
• 氢给体数：
  2
• 氢受体数：
  6

文献信息

• PROCESS FOR PRODUCTION OF PEPTIDE THIOESTER
  申请人：GLYTECH, INC.

  公开号：US20140249294A1

  公开（公告）日：2014-09-04

  A process for chemically converting a peptide chain into a peptide thioester includes, when a —C(═X)—R 1 group is introduced to the thiol group of the cysteine residue and then the resulting peptide is reacted with a compound having a leaving group represented by the formula: —NH—C(═Y)NHR 3 in an organic solvent, the —NH—C(═Y)NHR 3 group binds via addition reaction to the carboxyl group of the N-terminal-side peptide bond of the cysteine residue, whereby the peptide bond is cleaved and the C-terminal-side peptide fragment is cut off. Further, when the resulting peptide chain having the —NH—C(═Y)NHR 3 group is reacted with a thiol in a buffer solution, a thiol exchange reaction occurs, namely, the thiol group of the thiol binds to the carbonyl carbon to which the —NH—C(═Y)NHR 3 group has bound, whereby the —NH—C(═Y)NHR 3 group is eliminated.
• US9127041B2
  申请人：——

  公开号：US9127041B2

  公开（公告）日：2015-09-08