benzyl [2-(benzylamino)-2-oxoethyl]methylcarbamate | 1015255-73-8

• 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: benzyl [2-(benzylamino)-2-oxoethyl]methylcarbamate
• 英文别名: Benzyl (4-(benzylamino)-3,4-dioxobutyl)(methyl)carbamate；benzyl N-[3-(benzylamino)-2,3-dioxopropyl]-N-methylcarbamate
• CAS: 1015255-73-8
• 化学式: C₁₉H₂₀N₂O₄
• 分子量: 340.379
• InChiKey: RRVGEKFJVUAFHF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.14
• 重原子数：
  25.0
• 可旋转键数：
  7.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  75.71
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  benzyl [2-(benzylamino)-2-oxoethyl]methylcarbamate 、 3,6-二-2-吡啶基-1,2,4,5-四嗪 在 DL-脯氨酸 、 calcium chloride 作用下， 以 aq. phosphate buffer 为溶剂， 生成 Benzyl (5-(benzylcarbamoyl)-3,6-di(pyridin-2-yl)pyridazin-4-yl)(methyl)carbamate
  参考文献：
  名称：

  [EN] METHODS FOR PREPARING PYRIDAZINE COMPOUNDS
  [FR] PROCÉDÉS DE PRÉPARATION DE COMPOSÉS DE PYRIDAZINE

  摘要：

  The present invention is directed to a method for preparing pyridazine compounds, optionally pyridazine comprising (poly)peptides, (poly)peptide derivatives and peptidomimetics, by reacting a compound, optionally a (poly)peptide, (poly)peptide derivative or peptidomimetic, comprising at least one α-keto-ß3-glycine (aminopyruvate), with a non-, mono-, or disubstituted 1,2,4,5-tetrazine. It further relates to (poly)peptides, (poly)peptide derivatives and peptidomi-metics comprising at least one pyridazine, the pyridazine optionally forming part of the (poly)-peptide and peptidomimetic backbone, in particular to said (poly)peptides, (poly)peptide derivatives and peptidomimetics further comprising an analytical, purification, diagnostic, medicinal, reactive, solubilization and/or stabilization substituent(s) bound to at least one pyridazine. The invention also encompasses corresponding uses of these (poly)peptides, (poly)peptide derivatives and peptidomimetics for identification, quantification, purification, solubilization and stabilization, therapy and/or diagnosis.

  公开号：

  WO2023052526A1
• 作为产物：
  描述：

  (2-羟基乙基)甲基氨基甲酸苄酯 在 三氧化硫吡啶 、 碳酸氢钠 、 N,N-二异丙基乙胺 作用下， 以 甲醇 、 二甲基亚砜 为溶剂， 反应 26.17h， 生成 benzyl [2-(benzylamino)-2-oxoethyl]methylcarbamate
  参考文献：
  名称：

  [EN] METHODS FOR PREPARING PYRIDAZINE COMPOUNDS
  [FR] PROCÉDÉS DE PRÉPARATION DE COMPOSÉS DE PYRIDAZINE

  摘要：

  The present invention is directed to a method for preparing pyridazine compounds, optionally pyridazine comprising (poly)peptides, (poly)peptide derivatives and peptidomimetics, by reacting a compound, optionally a (poly)peptide, (poly)peptide derivative or peptidomimetic, comprising at least one α-keto-ß3-glycine (aminopyruvate), with a non-, mono-, or disubstituted 1,2,4,5-tetrazine. It further relates to (poly)peptides, (poly)peptide derivatives and peptidomi-metics comprising at least one pyridazine, the pyridazine optionally forming part of the (poly)-peptide and peptidomimetic backbone, in particular to said (poly)peptides, (poly)peptide derivatives and peptidomimetics further comprising an analytical, purification, diagnostic, medicinal, reactive, solubilization and/or stabilization substituent(s) bound to at least one pyridazine. The invention also encompasses corresponding uses of these (poly)peptides, (poly)peptide derivatives and peptidomimetics for identification, quantification, purification, solubilization and stabilization, therapy and/or diagnosis.

  公开号：

  WO2023052526A1

文献信息

• Synthesis of α-Ketoamides by a Molecular-Sieves-Promoted Formal Oxidative Coupling of Aliphatic Aldehydes with Isocyanides
  作者：Jean-Marie Grassot、Géraldine Masson、Jieping Zhu

  DOI：10.1002/anie.200704840

  日期：2008.1.18