((S)-1-{(S)-1-[(S)-1-((R)-4-Diethylcarbamoyl-3-methyl-thiazolidin-2-yl)-2-phenyl-ethylcarbamoyl]-ethylcarbamoyl}-2-methyl-propyl)-carbamic acid tert-butyl ester | 189459-09-4

• 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: ((S)-1-{(S)-1-[(S)-1-((R)-4-Diethylcarbamoyl-3-methyl-thiazolidin-2-yl)-2-phenyl-ethylcarbamoyl]-ethylcarbamoyl}-2-methyl-propyl)-carbamic acid tert-butyl ester
• 英文别名: tert-butyl N-[(2S)-1-[[(2S)-1-[[(1S)-1-[(4R)-4-(diethylcarbamoyl)-3-methyl-1,3-thiazolidin-2-yl]-2-phenylethyl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
• CAS: 189459-09-4
• 化学式: C₃₀H₄₉N₅O₅S
• 分子量: 591.816
• InChiKey: FJTTVWJOZOZUNC-XJKZSMJMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  41
• 可旋转键数：
  14
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  145
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  ((S)-1-{(S)-1-[(S)-1-((R)-4-Diethylcarbamoyl-3-methyl-thiazolidin-2-yl)-2-phenyl-ethylcarbamoyl]-ethylcarbamoyl}-2-methyl-propyl)-carbamic acid tert-butyl ester 在 水 、 copper(II) oxide 、 copper dichloride 作用下， 以 乙腈 为溶剂， 生成 {(S)-1-[(S)-1-((S)-1-Formyl-2-phenyl-ethylcarbamoyl)-ethylcarbamoyl]-2-methyl-propyl}-carbamic acid tert-butyl ester
  参考文献：
  名称：

  Synthesis of Peptidyl Aldehydes from Thiazolidines

  摘要：

  Peptidyl aldehydes were synthesized using thiazolidine peptides as precursors. Hydrolysis of the heterocycles is easily accomplished using cupper salts to furnish the peptidyl aldehydes with very good yield and with no epimerization. (C) 1997 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(97)00383-3
• 作为产物：
  描述：

  (R)-2-((S)-1-tert-Butoxycarbonylamino-2-phenyl-ethyl)-3-methyl-thiazolidine-4-carboxylic acid 在 (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate 、 N,N-二异丙基乙胺 、 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 生成 ((S)-1-{(S)-1-[(S)-1-((R)-4-Diethylcarbamoyl-3-methyl-thiazolidin-2-yl)-2-phenyl-ethylcarbamoyl]-ethylcarbamoyl}-2-methyl-propyl)-carbamic acid tert-butyl ester
  参考文献：
  名称：

  Synthesis of Peptidyl Aldehydes from Thiazolidines

  摘要：

  Peptidyl aldehydes were synthesized using thiazolidine peptides as precursors. Hydrolysis of the heterocycles is easily accomplished using cupper salts to furnish the peptidyl aldehydes with very good yield and with no epimerization. (C) 1997 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(97)00383-3

文献信息

• Synthesis of Peptidyl Aldehydes from Thiazolidines
  作者：Nathalie Galéotti*、Eric Plagnes、Patrick Jouin

  DOI：10.1016/s0040-4039(97)00383-3

  日期：1997.4

  Peptidyl aldehydes were synthesized using thiazolidine peptides as precursors. Hydrolysis of the heterocycles is easily accomplished using cupper salts to furnish the peptidyl aldehydes with very good yield and with no epimerization. (C) 1997 Published by Elsevier Science Ltd.