(R)-2-(methylamino)pentan-1-ol | 1016228-07-1

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: (R)-2-(methylamino)pentan-1-ol
• 英文别名: (2R)-2-(methylamino)pentan-1-ol
• CAS: 1016228-07-1
• 化学式: C₆H₁₅NO
• 分子量: 117.191
• InChiKey: WCHNLWZGJQDTDD-ZCFIWIBFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  8
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  32.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  5-(benzylthio)-7-chlorothiazolo[4,5-d]pyrimidin-2-amine 、 (R)-2-(methylamino)pentan-1-ol 在 N,N-二异丙基乙胺 作用下， 以 N-甲基吡咯烷酮 为溶剂， 反应 78.0h， 以76%的产率得到(2R)-2-{[2-amino-5-(benzylsulfanyl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl](methyl)amino}pentan-1-ol
  参考文献：
  名称：

  WO2008/39139

  摘要：

  公开号：
• 作为产物：
  描述：

  N-(ethoxycarbonyl)-D-norvaline 在 lithium aluminium tetrahydride 、 水 作用下， 以 四氢呋喃 为溶剂， 以71%的产率得到(R)-2-(methylamino)pentan-1-ol
  参考文献：
  名称：

  WO2008/39139

  摘要：

  公开号：

文献信息

• Benzoxaborole Antimalarial Agents. Part 5. Lead Optimization of Novel Amide Pyrazinyloxy Benzoxaboroles and Identification of a Preclinical Candidate
  作者：Yong-Kang Zhang、Jacob J. Plattner、Eric E. Easom、Robert T. Jacobs、Denghui Guo、Yvonne R. Freund、Pamela Berry、Vic Ciaravino、John C. L. Erve、Philip J. Rosenthal、Brice Campo、Francisco-Javier Gamo、Laura M. Sanz、Jianxin Cao

  DOI：10.1021/acs.jmedchem.7b00621

  日期：2017.7.13

  resistant to chloroquine and pyrimethamine. The rapid parasite in vitro reduction and in vivo parasite clearance profile of 46 were similar to those of artemisinin and chloroquine, two rapid-acting antimalarials. It was nongenotoxic in an Ames assay, an in vitro micronucleus assay, and an in vivo rat micronucleus assay when dosed orally up to 2000 mg/kg. The combined properties of this novel benzoxaborole

  为了确定具有令人满意的抗疟活性，理化性质，药代动力学特征，体内功效和安全性特征的分子，对羧酰胺基吡嗪酰氧基苯并氧杂硼酸酯进行了研究。这项优化工作发现了46个，满足了我们的目标候选人档案。化合物46对培养的恶性疟原虫具有优异的活性，并且在感染的小鼠体内对恶性疟原虫和伯氏疟原虫具有体内活性。它在小鼠，大鼠和狗中表现出良好的PK特性。它对其他11种恶性疟原虫非常活跃菌株，大多数对氯喹和乙胺嘧啶有抗性。46种体外快速寄生虫减少和体内寄生虫清除率特征与青蒿素和氯喹（两种速效抗疟药）相似。当口服剂量高达2000 mg / kg时，在Ames分析，体外微核分析和体内大鼠微核分析中均无遗传毒性。这种新颖的苯并氧杂硼酸酯的综合性能支持其向临床前发展的进程。
• Novel Compounds 480
  申请人：Johansson Rolf

  公开号：US20080318981A1

  公开（公告）日：2008-12-25

  There are disclosed novel 5,7-disubstituted [1,3]thiazolo[4,5-d]pyrimidin-2(3H)-one derivatives of formula (I) wherein R 1 , R 2 , R 3 , R 4 and n are as defined in the specification, and pharmaceutically acceptable salts thereof, together with processes for their preparation, pharmaceutical compositions comprising them and their use in therapy. The compounds of formula (I) are CX 3 CR 1 receptor antagonists and are thereby particularly useful in the treatment or prophylaxis of neurodegenerative disorders, demyelinating disease, cardio- and cerebrovascular atherosclerotic disorders, peripheral artery disease, rheumatoid arthritis, pulmonary diseases such as COPD, asthma or pain.

  本发明公开了一种新型的5,7-二取代[1,3]噻唑并[4,5-d]嘧啶-2(3H)-酮衍生物(I)，其中R1、R2、R3、R4和n在规范中定义，以及其药学上可接受的盐，以及它们的制备方法、含有它们的制药组合物和它们在治疗中的应用。化合物(I)是CX3CR1受体拮抗剂，因此在治疗或预防神经退行性疾病、脱髓鞘疾病、心血管和脑血管动脉粥样硬化性疾病、周围动脉疾病、类风湿性关节炎、COPD、哮喘或疼痛方面特别有用。
• 5,7-DISUBSTITUTED[1.3]THIAZOLO[4,5-d]PYRIMIDIN-2(3H)-AMINE DERIVATIVES AND THEIR USE IN THERAPY
  申请人：Johansson Rolf

  公开号：US20100035899A1

  公开（公告）日：2010-02-11

  There are disclosed novel 5-substituted 7-amino-[1,3]thiazolo[4,5-d]pyrimidine derivatives of formula (I) wherein R 1 , R 2 , R 3 , R 4 and n are as defined in the specification, and pharmaceutically acceptable salts thereof, together with processes for their preparation, pharmaceutical compositions comprising them and their use in therapy. The compounds of formula (I) are CX 3 CR1 receptor antagonists and are thereby particularly useful in the treatment or prophylaxis of neurodegenerative disorders, demyelinating disease, cardio- and cerebrovascular atherosclerotic disorders, peripheral artery disease, rheumatoid arthritis, pulmonary diseases such as COPD, asthma or pain.

  公开了一种新的式(I)的5-取代7-氨基-[1,3]噻唑[4,5-d]嘧啶衍生物，其中R1、R2、R3、R4和n如规范中所定义的，以及其药学上可接受的盐，以及它们的制备方法、包含它们的制药组合物和它们在治疗中的用途。式(I)化合物是CX3CR1受体拮抗剂，因此在神经退行性疾病、脱髓鞘性疾病、心血管和脑血管动脉粥样硬化性疾病、外周动脉疾病、类风湿性关节炎、COPD、哮喘或疼痛的治疗或预防中特别有用。
• 5,7-disubstituted[1.3]thiazolo [4,5-D] pyrimidin-2(3H)-amine derivatives and their use in therapy
  申请人：AstraZeneca AB

  公开号：US08158785B2

  公开（公告）日：2012-04-17

  There are disclosed novel 5-substituted 7-amino-[1,3]thiazolo[4,5-d]pyrimidine derivatives of formula (I) wherein R1, R2, R3, R4 and n are as defined in the specification, and pharmaceutically acceptable salts thereof, together with processes for their preparation, pharmaceutical compositions comprising them and their use in therapy. The compounds of formula (I) are CX3CR1 receptor antagonists and are thereby particularly useful in the treatment or prophylaxis of neurodegenerative disorders, demyelinating disease, cardio- and cerebrovascular atherosclerotic disorders, peripheral artery disease, rheumatoid arthritis, pulmonary diseases such as COPD, asthma or pain.

  公开了新型的5-取代的7-氨基-[1,3]噻唑[4,5-d]嘧啶衍生物的化学式(I)，其中R1、R2、R3、R4和n如规范中所定义，并且其药学上可接受的盐，以及其制备过程、包含它们的药物组合物和它们在治疗中的用途。化合物(I)是CX3CR1受体拮抗剂，因此在治疗或预防神经退行性疾病、脱髓鞘性疾病、心血管和脑血管动脉粥样硬化性疾病、周围动脉疾病、类风湿性关节炎、肺部疾病如COPD、哮喘或疼痛方面特别有用。
• 5,7-disubstituted thiazolo[4,5-d]pyrimidines for the selective inhibition of chemokine receptors
  申请人：AstraZeneca AB

  公开号：US07960395B2

  公开（公告）日：2011-06-14

  There are disclosed novel 5,7-disubstituted [1,3]thiazolo[4,5-d]pyrimidin-2(3H)-one derivatives of formula (I) wherein R1, R2, R3, R4 and n are as defined in the specification, and pharmaceutically acceptable salts thereof, together with processes for their preparation, pharmaceutical compositions comprising them and their use in therapy. The compounds of formula (I) are CX3CR1 receptor antagonists and are thereby particularly useful in the treatment or prophylaxis of neurodegenerative disorders, demyelinating disease, cardio- and cerebrovascular atherosclerotic disorders, peripheral artery disease, rheumatoid arthritis, pulmonary diseases such as COPD, asthma or pain.

  本发明涉及一种新的5,7-二取代[1,3]噻唑并[4,5-d]嘧啶-2(3H)-酮衍生物的公开，其化学式为(I)，其中R1、R2、R3、R4和n如规范中所定义，并且其药学上可接受的盐，以及它们的制备方法、包含它们的制药组合物和它们在治疗中的应用。化合物(I)是CX3CR1受体拮抗剂，因此特别适用于治疗或预防神经退行性疾病、脱髓鞘疾病、心脏和脑血管动脉粥样硬化性疾病、周围动脉疾病、类风湿性关节炎、COPD、哮喘或疼痛等肺部疾病。