2-methyl-1,2,3,4-tetrahydro-1H-2-benzazepine | 188570-15-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯氮卓类
• 英文名称: 2-methyl-1,2,3,4-tetrahydro-1H-2-benzazepine
• 英文别名: 1,3,4,5-tetrahydro-N-methylbenzazepine；2-methyl-2,3,4,5-tetrahydro-1H-2-benzazepine；2-methyl-1,3,4,5-tetrahydro-2-benzazepine
• CAS: 188570-15-2
• 化学式: C₁₁H₁₅N
• mdl: MFCD05148691
• 分子量: 161.247
• InChiKey: WYXGDJDZARDNJX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.454
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  二苯甲酮 、 2-methyl-1,2,3,4-tetrahydro-1H-2-benzazepine 在 仲丁基锂 作用下， 以 乙醚 、 甲苯 、 正戊烷 为溶剂， 以31%的产率得到5-(α,α-diphenylmethylcarbinol)-2-methyl-1,2,3,4-tetrahydro-1H-2-benzazepine
  参考文献：
  名称：

  ‘Counter-intuitive’ regioselectivity, subtle steric and solvation effects in lithiation of cyclic tertiary aralkylamines

  摘要：

  Lithiation of a series of cyclic aralkyl tertiary amines with sec-BuLi in various solvents has been studied. There is a subtle sensitivity to steric factors and lithium coordinating solvents/additives have an adverse effect. ortho-Lithiation is observed only in the case of an eight-membered cyclic amine and the ease of benzylic lithiation with respect to nitrogen is in the surprising order gamma > beta >> alpha, delta. These observations are discussed in the context of nitrogen coordination promoted lithiation. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.07.110
• 作为产物：
  描述：

  聚合甲醛 、 2,3,4,5-四氢-1H-2-苯并氮杂卓 在 甲酸 作用下， 以 水 为溶剂， 以63 %的产率得到2-methyl-1,2,3,4-tetrahydro-1H-2-benzazepine
  参考文献：
  名称：

  立体氮中心的对映选择性烯丙基化

  摘要：

  大多数具有立构氮中心的叔胺在室温下会发生快速外消旋化。因此，在动态动力学拆分下胺的季铵化似乎是可行的。N-甲基四氢异喹啉通过 Pd 催化的烯丙基烷基化转化为构型稳定的铵离子。条件的优化和底物范围的评估实现了高转化率和高达 10:90 的对映体比例。我们在这里报告了手性铵离子的对映选择性催化合成的第一个例子。

  DOI：

  10.1021/acs.orglett.3c00195

文献信息

• [EN] DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS<br/>[FR] INHIBITEURS DOUBLES DE NAV1.2/5HT2A POUR TRAITER DES TROUBLES DU SNC
  申请人：SUNOVION PHARMACEUTICALS INC

  公开号：WO2018026371A1

  公开（公告）日：2018-02-08

  Compounds of formula I: I are disclosed, as are pharmaceutical compositions containing such compounds. Methods of treating neurological or psychiatric disorders in a patient in need are also disclosed. Such disorders include depression, bipolar disorder, pain, schizophrenia, obsessive compulsive disorder, addiction, social disorder, attention deficit hyperactivity disorder, an anxiety disorder, autism, a cognitive impairment, or a neuropsychiatric symptom such as apathy, depression, anxiety, psychosis, aggression, agitation, impulse control disorders, and sleep disorders in neurological disorders such as Alzheimer's and Parkinson's diseases.

  公开了化学式I的化合物，以及含有这些化合物的药物组合物。还公开了治疗患有神经系统或精神障碍的患者的方法。这些障碍包括抑郁症、躁郁症、疼痛、精神分裂症、强迫症、成瘾、社交障碍、注意力缺陷多动障碍、焦虑障碍、自闭症、认知障碍，或神经精神症状，如冷漠、抑郁、焦虑、精神病、攻击性、激动、冲动控制障碍，以及在神经系统疾病如阿尔茨海默病和帕金森病中的睡眠障碍。
• Dihydrothienopyrimidines
  申请人：GERLACH Kia

  公开号：US20130196988A1

  公开（公告）日：2013-08-01

  The present invention relates to dihydrothienopyrimidines, their use as modulators of γ-secretase and to pharmaceutical compositions containing said compounds. In particular, the present invention relates to compounds which interfere with γ-secretase and/or its substrate and therefore modulate the formation of Aβ peptides.

  本发明涉及二氢噻吡嘧啶类化合物，其作为γ-分泌酶调节剂的用途，以及含有这些化合物的药物组合物。具体而言，本发明涉及干扰γ-分泌酶和/或其底物的化合物，从而调节Aβ肽的形成。
• COMPOUNDS
  申请人：HEER Jag Paul

  公开号：US20100174065A1

  公开（公告）日：2010-07-08

  The present invention relates to novel oxadiazole derivatives having pharmacological activity, processes for their preparation, pharmaceutical compositions containing them and their use in the treatment of various disorders.

  本发明涉及具有药理活性的新型噁二唑衍生物，其制备方法，含有它们的药物组合物以及它们在治疗各种疾病中的用途。
• POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, OPTICALLY ANISOTROPIC BODY, AND METHOD FOR PRODUCING POLYMERIZABLE COMPOUND
  申请人：ZEON CORPORATION

  公开号：US20150175564A1

  公开（公告）日：2015-06-25

  A polymerizable compound has a practical low melting point, excellent solubility in a general-purpose solvent, and can produce an optical film at low cost, exhibits low reflected luminance, and achieves uniform conversion of polarized light over a wide wavelength band, an optically anisotropic article. A carbonyl compound is useful as a raw material for producing the polymerizable compound. (In the formula (I), Y 1 to Y 8 represent —C(═O)—O—, G 1 and G 2 represent a C 1-20 divalent linear aliphatic group, Z 1 and Z 2 represent a C 2-10 alkenyl group that is unsubstituted, or substituted with a halogen atom, A x represents a C 2-30 organic group with at least one aromatic ring, A y represents a hydrogen atom or C 1-20 alkyl group, A 1 represents a trivalent aromatic group, A 2 and A 3 represent a C 3-30 divalent alicyclic hydrocarbon group, A 4 and A 5 represent a C 6-30 divalent aromatic group or the like, and Q 1 represents a hydrogen atom.)

  一种可聚合的化合物具有实用的低熔点、在通用溶剂中良好的溶解性，并且可以以低成本制备光学薄膜，表现出较低的反射亮度，并且在宽波长范围内实现偏振光的均匀转换，是一种光学各向异性材料。一种羰基化合物可作为制备可聚合化合物的原料。（在式（I）中，Y1至Y8代表—C(═O)—O—，G1和G2代表C1-20二价线性脂肪族基团，Z1和Z2代表未取代或取代有卤素原子的C2-10烯基基团，Ax代表至少具有一个芳香环的C2-30有机基团，Ay代表氢原子或C1-20烷基基团，A1代表三价芳香族基团，A2和A3代表C3-30二价脂环碳氢基团，A4和A5代表C6-30二价芳香族基团或类似物，Q1代表氢原子。）
• POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC SUBSTANCE
  申请人：ZEON CORPORATION

  公开号：US20150274647A1

  公开（公告）日：2015-10-01

  The present invention relates to: a polymerizable compound represented by a formula (I); a polymerizable composition comprising the polymerizable compound and an initiator; a polymer obtained by polymerizing the polymerizable compound or the polymerizable composition; and an optically anisotropic article comprising the polymer [in the formula, Y 1 to Y 8 are a chemical single bond, —O—, —O—C(═O)—, —C(═O)—O—, or the like; G 1 and G 2 are a divalent aliphatic group having 1 to 20 carbon atoms, or the like; Z 1 and Z 2 are an alkenyl group having 2 to 10 carbon atoms, or the like; A 1 is a tetravalent aromatic group, or the like; A 2 and A 3 are a divalent alicyclic hydrocarbon group having 3 to 30 carbon atoms, or the like; A 4 and A 5 are a divalent aromatic group having 4 to 30 carbon atoms, or the like; A x1 and A x2 are an organic group having 2 to 30 carbon atoms that includes an aromatic ring, or the like; A y1 and A y2 are a hydrogen atom, an alkyl group having 1 to 6 carbon atoms, or the like; Q 1 and Q 2 are a hydrogen atom, an alkyl group having 1 to 6 carbon atoms, or the like; and m and n are 0 or 1]. According to the present invention, a polymerizable compound, a polymerizable composition, and a polymer that have a practical low melting point, exhibit excellent solubility in a general-purpose solvent, can be produced at low cost, and can produce an optical film that achieves uniform conversion of polarized light over a wide wavelength band, and also provide an optically anisotropic article.

  本发明涉及：由式(I)表示的可聚合化合物；包括所述可聚合化合物和引发剂的可聚合组合物；通过聚合所述可聚合化合物或可聚合组合物得到的聚合物；以及包括所述聚合物的光学各向异性物品[在该式中，Y1至Y8为化学单键，—O—，—O—C(═O)—，—C(═O)—O—等；G1和G2为具有1至20个碳原子的二价脂肪族基等；Z1和Z2为具有2至10个碳原子的烯基基团等；A1为四价芳香族基等；A2和A3为具有3至30个碳原子的二价脂环烃基等；A4和A5为具有4至30个碳原子的二价芳香族基等；Ax1和Ax2为包括芳香环的具有2至30个碳原子的有机基团等；Ay1和Ay2为氢原子、具有1至6个碳原子的烷基基团等；Q1和Q2为氢原子、具有1至6个碳原子的烷基基团等；m和n为0或1]。根据本发明，可以制备具有实用低熔点、在通用溶剂中具有优异溶解性、成本低廉的可聚合化合物、可聚合组合物和聚合物，并且可以生产出在宽波长范围内实现偏振光均匀转换的光学薄膜，同时提供光学各向异性物品。