Metaphit | 96316-00-6

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: Metaphit
• 英文别名: 1-[1-(3-isothiocyanatophenyl)cyclohexyl]piperidine
• CAS: 96316-00-6
• 化学式: C₁₈H₂₄N₂S
• 分子量: 300.5
• InChiKey: FGSGBQAQSPSRJK-UHFFFAOYSA-N

物化性质

• 溶解度：
  可溶于水中

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  47.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  3-[1-(1-哌啶基)环己基]苯胺 、 硫光气 生成 Metaphit
  参考文献：
  名称：

  RICE, KENNER C.;RAFFERTY, MICHAEL F.;JACOBSON, ARTHUR E.;CONTRERAS, PATRI+

  摘要：

  DOI：

文献信息

• Metaphit and related compounds as acylating agents for the
  申请人：The United States of America as represented by the Department of Health

  公开号：US04762846A1

  公开（公告）日：1988-08-09

  A derivative of phencyclidine (1) bearing an isothiocyanate moiety on the meta position of the aromatic ring (3; Metaphit as methanesulfonate and HCl salt) has been synthesized and identified as a rapid and specific site-directed acylating agent of the [.sup.3 H]-phencyclidine binding site in rat brain homogenates. Additional related compounds to Metaphit are Thiophit (oxalate salt), Ethylphit (HCl salt), and Isopropylphit (HCl salt).

  一种苯环上的异硫氰酸酯衍生物（1）（Metaphit作为甲烷磺酸盐和HCl盐）已经合成并鉴定为一种快速而特异性的定向酰化试剂，可作用于大鼠脑均浆中的[.sup.3 H]-phencyclidine结合位点。与Metaphit相关的其他化合物包括Thiophit（草酸盐）、Ethylphit（HCl盐）和Isopropylphit（HCl盐）。
• Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions
  申请人：Köster Hubert

  公开号：US20110118136A1

  公开（公告）日：2011-05-19

  Capture compounds and collections thereof and methods using the compounds for the analysis of biomolecules are provided. In particular, collections, compounds and methods are provided for analyzing complex protein mixtures, such as the proteome. The compounds are multifunctional reagents that provide for the separation and isolation of complex protein mixtures. Each compound has the formula: wherein: Z is a trityl derivative; X, the reactivity function, covalently binds to amino acid side chains of proteins; Y, the selectivity function, modulates binding of X to the amino acid side chains in proteins such that X binds to fewer proteins when Y is present than in its absence; and Q permits separation or immobilization of the capture compound. Automated systems for performing the methods also are provided.

  本文提供了捕获化合物和化合物集合以及使用这些化合物进行生物分子分析的方法。特别地，提供了用于分析复杂蛋白质混合物（如蛋白质组）的集合、化合物和方法。这些化合物是多功能试剂，可用于分离和分离复杂蛋白质混合物。每个化合物的公式为：其中：Z是三苯甲基衍生物；X是反应性功能，共价结合到蛋白质的氨基酸侧链上；Y是选择性功能，调节X与蛋白质中氨基酸侧链的结合，使得在Y存在时，X与较少的蛋白质结合，而在Y不存在时，X与更多的蛋白质结合；Q允许分离或固定捕获化合物。本文还提供了用于执行这些方法的自动化系统。
• N-(1-thienylcycloalkyl)alkenylamines for treatment of neurotoxic injury
  申请人：G.D. Searle & Co.

  公开号：EP0317953A2

  公开（公告）日：1989-05-31

  Compounds, compositions and methods of treatment are described to control brain damage associated with anoxia or ischemia which typically follows stroke, cardiac arrest or perinatal asphyxia. The treatment includes administration of an N-(1-thienylcycloalkyl)alkenylamine compound as an antagonist to inhibit excitotoxic actions at major neuronal excitatory amino acid receptor sites. Compounds of most interest are those of the formula wherein R¹ is one or more groups selected from hydrido, alkyl of one to about five carbon atoms, cycloalkyl of three to about five carbon atoms, alkenyl of two to about five carbon atoms, hydroxyl and alkoxy; wherein each of R² is one or more groups selected from hydrido, alkyl of one to about five carbon atoms, cycloalkyl of three to about five carbon atoms, alkenyl of two to about five carbon atoms, hydroxyl, oxo and alkoxy; wherein R⁵ is one or more groups selected from hydrido, alkyl of one to about five carbon atoms, cycloalkyl of three to about five carbon atoms, alkenyl of two to about five carbon atoms, hydroxyl and alkoxy; and wherein the broken line within the N-containing ring represents a double bond between any two adjacent carbon atoms involving the 3-, 4- and 5-positions of the N-containing ring.

  所述化合物、组合物和治疗方法可控制与缺氧或缺血有关的脑损伤，缺氧或缺血通常是中风、心脏骤停或围产期窒息之后的症状。治疗方法包括施用 N-（1-噻吩基环烷基）烯胺化合物作为拮抗剂，以抑制主要神经元兴奋性氨基酸受体位点的兴奋毒性作用。最令人感兴趣的化合物是那些式中 其中 R¹ 是一个或多个基团，选自氢基、一至约五个碳原子的烷基、三至约五个碳原子的环烷基、二至约五个碳原子的烯基、羟基和烷氧基；其中每个 R² 是一个或多个基团，选自氢基、一至约五个碳原子的烷基、三至约五个碳原子的环烷基、二至约五个碳原子的烯基、羟基、氧代和烷氧基；其中 R⁵是一个或多个基团，选自水rido、1 至 5 个碳原子的烷基、3 至 5 个碳原子的环烷基、2 至 5 个碳原子的烯基、羟基和烷氧基；且其中含 N 环内的断线代表涉及含 N 环的 3、4 和 5 位的任意两个相邻碳原子之间的双键。
• RICE, KENNER C.;RAFFERTY, MICHAEL F.;JACOBSON, ARTHUR E.;CONTRERAS, PATRI+
  作者：RICE, KENNER C.、RAFFERTY, MICHAEL F.、JACOBSON, ARTHUR E.、CONTRERAS, PATRI+

  DOI：——

  日期：——
• EP3193852A1
  申请人：——

  公开号：EP3193852A1

  公开（公告）日：2017-07-26