N-cyclopropyl-6-{1-[(3-trifluoromethylisoxazol-5-yl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}picolinamide hydrochloride | 1206550-44-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: N-cyclopropyl-6-{1-[(3-trifluoromethylisoxazol-5-yl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}picolinamide hydrochloride
• 英文别名: N-cyclopropyl-6-[1-[[3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]-3,6-dihydro-2H-pyridin-4-yl]pyridine-2-carboxamide;hydrochloride
• CAS: 1206550-44-8
• 化学式: C₁₉H₁₉F₃N₄O₂*ClH
• 分子量: 428.842
• InChiKey: WRINJAOUNSMKSZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.69
• 重原子数：
  29
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  71.3
• 氢给体数：
  2
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  N-cyclopropyl-6-(1,2,3,6-tetrahydropyridin-4-yl)picolinamide 、 3-(trifluoromethyl)isoxazole-5-carbaldehyde 在 溶剂黄146 、 三乙酰氧基硼氢化钠 作用下， 以 四氢呋喃 为溶剂， 反应 16.0h， 以14%的产率得到N-cyclopropyl-6-{1-[(3-trifluoromethylisoxazol-5-yl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}picolinamide hydrochloride
  参考文献：
  名称：

  Tetrahydropyridinyl and Dihydropyrrolyl Compounds and the Use Thereof

  摘要：

  这项发明涉及式(I)的四氢吡啶基和二氢吡咯基化合物，以及其药学上可接受的盐、前药或溶剂化合物，其中X、Y、Z、R1、R2、m和n的定义如规范中所述。该发明还涉及利用式(I)的化合物治疗对钙通道阻滞有反应的疾病，特别是N型钙通道。本发明的化合物特别适用于治疗疼痛。

  公开号：

  US20110136833A1

文献信息

• Tetrahydropyridinyl and dihydropyrrolyl compounds and the use thereof
  申请人：Purdue Pharma L.P.

  公开号：US08324249B2

  公开（公告）日：2012-12-04

  The invention relates to tetrahydropyridinyl and dihydropyrrolyl compounds of Formula (I): and pharmaceutically acceptable salts, prodrugs, or solvates thereof, wherein X, Y, Z, R1, R2, m, and n are defined as set forth in the specification. The invention is also directed to the use of compounds of Formula (I) to treat a disorder responsive to the blockade of calcium channels, and particularly N-type calcium channels. Compounds of the present invention are especially useful for treating pain.

  本发明涉及公式（I）的四氢吡啶基和二氢吡咯基化合物及其药学上可接受的盐、前药或溶剂合物，其中X、Y、Z、R1、R2、m和n如规范中所述。本发明还涉及使用公式（I）的化合物治疗对钙通道阻滞有反应的疾病，特别是N型钙通道。本发明的化合物特别适用于治疗疼痛。
• TETRAHYDROPYRIDINYL AND DIHYDROPYRROLYL COMPOUNDS AND THE USE THEREOF
  申请人：Purdue Pharma LP

  公开号：EP2331522A2

  公开（公告）日：2011-06-15
• US8324249B2
  申请人：——

  公开号：US8324249B2

  公开（公告）日：2012-12-04
• [EN] TETRAHYDROPYRIDINYL AND DIHYDROPYRROLYL COMPOUNDS AND THE USE THEREOF<br/>[FR] COMPOSÉS DE TÉTRAHYDRO-PYRIDINYLE ET DE DIHYDRO-PYRROLYLE
  申请人：PURDUE PHARMA LP

  公开号：WO2010014257A2

  公开（公告）日：2010-02-04

  The invention relates to tetrahydropyridinyl and dihydropyrrolyl compounds of Formula (I): and pharmaceutically acceptable salts, prodrugs, or solvates thereof, wherein X, Y, Z, R1, R2, m, and n are defined as set forth in the specification. The invention is also directed to the use of compounds of Formula (I) to treat a disorder responsive to the blockade of calcium channels, and particularly N-type calcium channels. Compounds of the present invention are especially useful for treating pain.
• Tetrahydropyridinyl and Dihydropyrrolyl Compounds and the Use Thereof
  申请人：Mikamiyama Hidenori

  公开号：US20110136833A1

  公开（公告）日：2011-06-09

  The invention relates to tetrahydropyridinyl and dihydropyrrolyl compounds of Formula (I): and pharmaceutically acceptable salts, prodrugs, or solvates thereof, wherein X, Y, Z, R 1 , R 2 , m, and n are defined as set forth in the specification. The invention is also directed to the use of compounds of Formula (I) to treat a disorder responsive to the blockade of calcium channels, and particularly N-type calcium channels. Compounds of the present invention are especially useful for treating pain.

  这项发明涉及式(I)的四氢吡啶基和二氢吡咯基化合物，以及其药学上可接受的盐、前药或溶剂化合物，其中X、Y、Z、R1、R2、m和n的定义如规范中所述。该发明还涉及利用式(I)的化合物治疗对钙通道阻滞有反应的疾病，特别是N型钙通道。本发明的化合物特别适用于治疗疼痛。