toluene-4-sulfonic acid (2R)-8-amino-7-nitro-2,3-dihydro-benzo(1,4)dioxin-2-ylmethyl ester

• 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: toluene-4-sulfonic acid (2R)-8-amino-7-nitro-2,3-dihydro-benzo(1,4)dioxin-2-ylmethyl ester
• 英文别名: toluene-4-Sulfonic Acid 8-Amino-7-Nitro-2,3-Dihydro-Benzo(1,4)Dioxin-2-Ylmethyl Ester；(5-Amino-6-nitro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate
• 化学式: C₁₆H₁₆N₂O₇S
• 分子量: 380.378
• InChiKey: QBVMQKVCVXOILN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  142
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  toluene-4-sulfonic acid (2R)-8-amino-7-nitro-2,3-dihydro-benzo(1,4)dioxin-2-ylmethyl ester 、 对甲苯磺酸甲酯 在 potassium carbonate 、 N,N-二异丙基乙胺 、 三氟乙酸酐 作用下， 以 甲醇 、 二氯甲烷 、 2,2,2-三氟乙酰胺 、 水 、 N,N-二甲基甲酰胺 为溶剂， 生成 toluene-4-sulfonic acid 8-methylamino-7-nitro-2,3-dihydro-benzo(1,4)dioxin-2-ylmethyl ester
  参考文献：
  名称：

  Antidepressant azaheterocyclylmethyl derivatives of 7,8-dihydro-3H-6,9-dioxa-1,3-diazacyclopenta[a]naphthalene

  摘要：

  式1的化合物对治疗抑郁症和其他疾病如强迫症、恐慌症、广泛性焦虑症、社交焦虑症、性功能障碍、饮食障碍、肥胖症、由乙醇或可卡因滥用引起的成瘾性障碍及相关疾病具有益处。

  公开号：

  US20040010006A1

文献信息

• Antidepressant azaheterocyclylmethyl derivatives of 2,3-dihydro-1,4-dioxino[2,3-f]quinoxaline
  申请人：Wyeth

  公开号：US20020183329A1

  公开（公告）日：2002-12-05

  Compounds of the formula: 1 are useful for the treatment of depression and other diseases such as obsessive compulsive disorder, panic attacks, generalized anxiety disorder, social anxiety disorder, sexual dysfunction, eating disorders, obesity, addictive disorders caused by ethanol or cocaine abuse and related illnesses.

  该公式化合物用于治疗抑郁症和其他疾病，如强迫症、恐慌发作、广泛性焦虑障碍、社交焦虑障碍、性功能障碍、进食障碍、肥胖症、由乙醇或可卡因滥用引起的成瘾障碍以及相关疾病。
• Antidepressant azaheterocyclylmethyl derivatives of 2,3-dihydro-1,4-Dioxino[2,3-f]quinoxaline
  申请人：Wyeth

  公开号：US20040077652A1

  公开（公告）日：2004-04-22

  Compounds of the formula: 1 are useful for the treatment of depression and other diseases such as obsessive compulsive disorder, panic attacks, generalized anxiety disorder, social anxiety disorder, sexual dysfunction, eating disorders, obesity, addictive disorders caused by ethanol or cocaine abuse and related illnesses.

  该式化合物：1对治疗抑郁症和其他疾病（如强迫症、恐慌发作、广泛性焦虑障碍、社交焦虑障碍、性功能障碍、进食障碍、肥胖症、由乙醇或可卡因滥用引起的成瘾障碍及相关疾病）具有益处。
• Antipsychotic aminomethyl derivatives of 1,3,7,8-tetrahydro-6,9-dioxa-1,3-diaza-cyclopenta[a]-naphthalen-2-one
  申请人：Wyeth

  公开号：US20030045526A1

  公开（公告）日：2003-03-06

  Compounds of the formula: 1 useful for treatment of disorders of the dopaminergic system, such as schizophrenia, schizoaffective disorder, bipolar disorder, Parkinson's disease, L-DOPA induced pychoses and dyskinesias, Tourette's syndrome and hyperprolactinemia and in the treatment of drug addiction such as the addiction to ethanol, nicotine or cocaine and related illnesses.

  该公式化合物用于治疗多巴胺系统紊乱，如精神分裂症、情感性精神分裂症、双相情感障碍、帕金森病、L-多巴诱导的精神病和运动障碍、图雷特综合症、高泌乳素血症以及药物成瘾，如对乙醇、尼古丁或可卡因的成瘾以及相关疾病的治疗。
• Antipsychotic aminomethyl derivatives of 7,8-dihydro-3H-6,9-dioxa-1,3-diaza-cyclopenta[a]naphthalene
  申请人：American Home Products Corporation

  公开号：US20020183330A1

  公开（公告）日：2002-12-05

  Compounds of the formula 1 useful for treatment of disorders of the dopaminergic system, such as schizophrenia, schizoaffective disorder, bipolar disorder, Parkinson's disease, L-DOPA induced pychoses and dyskinesias, Tourette's syndrome and hyperprolactinemia and in the treatment of drug addiction such as the addiction to ethanol, nicotine or cocaine and related illnesses.

  公式1的化合物对于治疗多巴胺系统的疾病非常有用，例如精神分裂症，情感性精神障碍，躁郁症，帕金森病，L-DOPA诱导的精神病和运动障碍，托瑞特综合症和高泌乳素血症，以及治疗药物成瘾，如对乙酰酒精，尼古丁或可卡因的成瘾和相关疾病。
• Antidepressant Piperidine Derivatives of Heterocycle-Fused Benzodioxans
  申请人：Webb Michael Byron

  公开号：US20090042895A1

  公开（公告）日：2009-02-12

  Compounds of the Formula: are useful for the treatment of depression (including but not limited to major depressive disorder, childhood depression and dysthymia), anxiety, panic disorder, post-traumatic stress disorder, premenstrual dysphoric disorder (also known as pre-menstrual syndrome), attention deficit disorder (with and without hyperactivity), obsessive compulsive disorder, social anxiety disorder, generalized anxiety disorder, obesity, eating disorders such as anorexia nervosa and bulimia nervosa, vasomotor flushing, cocaine and alcohol addiction, sexual dysfunction and related illnesses.

  公式为：的化合物可用于治疗抑郁症（包括但不限于重度抑郁症、儿童抑郁症和心境恶劣）、焦虑症、恐慌症、创伤后应激障碍、经前期症候群（也称经前综合征）、注意力缺陷多动障碍（有和无过动症）、强迫症、社交焦虑症、广泛性焦虑症、肥胖症、饮食失调如厌食症和贪食症、潮红、可卡因和酒精成瘾、性功能障碍及相关疾病。