tert-butyl benzyloxy(ethyl)carbamate

• 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: tert-butyl benzyloxy(ethyl)carbamate
• 英文别名: Tert-butyl benzyloxy(ethyl)carbamate；tert-butyl N-ethyl-N-phenylmethoxycarbamate
• 化学式: C₁₄H₂₁NO₃
• 分子量: 251.326
• InChiKey: UMCQWGKPYZMMKN-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：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  38.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  tert-butyl benzyloxy(ethyl)carbamate 在 盐酸 作用下， 生成 N-ethyl-O-benzylhydroxylamine
  参考文献：
  名称：

  Significance of Hydrogen Bonding at the S1′ Subsite of Calpain I

  摘要：

  alpha -Ketohydroxamates were synthesized as bioisosteres of alpha -ketoamides. The alpha -ketohydroxamates were generally more potent than the corresponding alpha -ketoamides. The potency of the compounds suggests that hydrogen bonding and steric bulk of substituents on the nitrogen atom of the ketoamide moiety influence calpain inhibition. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00301-8
• 作为产物：
  描述：

  O-苄基羟胺 在 sodium hydride 作用下， 以 四氢呋喃 、 水 为溶剂， 生成 tert-butyl benzyloxy(ethyl)carbamate
  参考文献：
  名称：

  Effect of Substituents and Stability of Transient Aluminum–Aminals­ in the Presence of Nucleophiles

  摘要：

  Disubstituted hydroxylamines are synthesized and used to form aluminum-amide complexes. These reagents mask carbonyl groups in situ via nucleophilic addition. The stability and utility of the aluminum-aminals are presented in the context of selectively controlling nucleophilic addition on substrates with multiple carbonyl groups.

  DOI：

  10.1055/s-0034-1379635

文献信息

• NEW INHIBITORS OF CYCLOPHILINS AND USES THEREOF
  申请人：Guichou Jean-Francois

  公开号：US20130018044A1

  公开（公告）日：2013-01-17

  The present invention relates to a compound of formula (I): wherein: n is 0, 1 or 2; A is in particular CH or N; X is in particular CO, SO 2 , CS, and R 1 is in particular H, R 2 is a group of formula NR 3 R 4 or OR 5 , R 3 and R 4 being in particular H, and R 5 an alkyl group, R 6 is in particular H or an alkyl group, and R 7 is in particular an aryl group, for its use in the prevention and/or the treatment of viral pathologies or infections.

  本发明涉及式(I)的化合物：其中：n为0、1或2；A特别为CH或N；X特别为CO、SO2、CS，R1特别为H，R2为式NR3R4或OR5的基团，其中，R3和R4特别为H，R5为烷基，R6特别为H或烷基，R7特别为芳基，用于预防和/或治疗病毒病理或感染。
• New Inhibitors of Cyclophilins and Uses Thereof
  申请人：Institut National de la Sante et de la Recherche Medicale (INSERM)

  公开号：US20140179687A1

  公开（公告）日：2014-06-26

  The present invention relates to a compound of formula (I): wherein: n is 0, 1 or 2; A is in particular CH or N; X is in particular CO, SO 2 , CS, and R 1 is in particular H, R 2 is a group of formula NR 3 R 4 or OR 5 , R 3 and R 4 being in particular H, and R 5 an alkyl group, R 6 is in particular H or an alkyl group, and R 7 is in particular an aryl group, for its use in the prevention and/or the treatment of viral pathologies or infections.

  本发明涉及一种式子为(I)的化合物：其中：n为0、1或2；A特指CH或N；X特指CO、SO2、CS，R1特指H，R2为式子NR3R4或OR5，其中，R3和R4特指H，R5为烷基；R6特指H或烷基；R7特指芳基，用于预防和/或治疗病毒病理或感染。
• Inhibitors of cyclophilins and uses thereof
  申请人：Guichou Jean-Francois

  公开号：US08802666B2

  公开（公告）日：2014-08-12

  The present invention relates to a compound of formula (I): wherein: n is 0, 1 or 2; A is in particular CH or N; X is in particular CO, SO2, CS, and R1 is in particular H, R2 is a group of formula NR3R4 or OR5, R3 and R4 being in particular H, and R5 an alkyl group, R6 is in particular H or an alkyl group, and R7 is in particular an aryl group, for its use in the prevention and/or the treatment of viral pathologies or infections.

  本发明涉及一种化合物，其化学式为(I)：其中：n为0、1或2；A特指CH或N；X特指CO、SO2、CS，R1特指H，R2为NR3R4或OR5的基团，其中R3和R4特指H，R5为烷基；R6特指H或烷基；R7特指芳基。该化合物用于预防和/或治疗病毒病理或感染。
• Significance of Hydrogen Bonding at the S1′ Subsite of Calpain I
  作者：Isaac O. Donkor、Xiaozhang Zheng、Jie Han、Calvin Lacy、Duane D. Miller

  DOI：10.1016/s0960-894x(01)00301-8

  日期：2001.7

  alpha -Ketohydroxamates were synthesized as bioisosteres of alpha -ketoamides. The alpha -ketohydroxamates were generally more potent than the corresponding alpha -ketoamides. The potency of the compounds suggests that hydrogen bonding and steric bulk of substituents on the nitrogen atom of the ketoamide moiety influence calpain inhibition. (C) 2001 Elsevier Science Ltd. All rights reserved.
• [EN] NEW INHIBITORS OF CYCLOPHILINS AND USES THEREOF<br/>[FR] NOUVEAUX INHIBITEURS DE CYCLOPHILINES ET LEURS UTILISATIONS
  申请人：INST NAT SANTE RECH MED

  公开号：WO2011076784A3

  公开（公告）日：2011-11-10