1-[3-(4-Diethylcarbamoylphenyl)-3-(2-methoxyphenyl)propyl]-4-(2-hydroxymethyl-1H-benzimidazol-1-yl)piperidine | 363172-89-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 1-[3-(4-Diethylcarbamoylphenyl)-3-(2-methoxyphenyl)propyl]-4-(2-hydroxymethyl-1H-benzimidazol-1-yl)piperidine
• 英文别名: N,N-diethyl-4-[3-[4-[2-(hydroxymethyl)benzimidazol-1-yl]piperidin-1-yl]-1-(2-methoxyphenyl)propyl]benzamide
• CAS: 363172-89-8
• 化学式: C₃₄H₄₂N₄O₃
• 分子量: 554.732
• InChiKey: NWYNDEOEERUTGT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  41
• 可旋转键数：
  11
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  70.8
• 氢给体数：
  1
• 氢受体数：
  5

文献信息

• Diphenylalkylamine derivatives useful as opioid receptor agonists
  申请人：——

  公开号：US20030176693A1

  公开（公告）日：2003-09-18

  A substance having affinity for an opioid &dgr; receptor, which is represented by the following general formula (I): 1 wherein, X represents a group of the general formula: —CO—N(R 5 )(R 6 ) (II) and the like, n represents 1 to 3, R 1 and R 2 represent a hydrogen atom, a halogen atom, a lower alkyl group and the like, R 3 represents a hydrogen atom, a halogen atom, a lower alkyl group and the like, R 4 represents a saturated or unsaturated monocyclic or bicyclic carbocyclic group and the like, R 5 to R 12 represent a hydrogen atom, a lower alkyl group and the like, and R 3 and R 4 , R 5 and R 6 , R 7 or R 8 and R 9 and R 10 may bind to each other to form a cyclic structure, and a medicament useful for preventive and/or therapeutic treatment of central nervous system diseases and peripheral nervous system diseases comprising the substance as an active ingredient.

  一种具有与阿片受体δ亲和力的物质，其由以下一般公式（I）表示：其中，X代表一般公式的一个基团：—CO—N（R5）（R6）（II）等，n代表1至3，R1和R2代表氢原子、卤素原子、低碳烷基团等，R3代表氢原子、卤素原子、低碳烷基团等，R4代表饱和或不饱和的单环或双环碳环基团等，R5到R12代表氢原子、低碳烷基团等，R3和R4、R5和R6、R7或R8和R9以及R10可能相互结合形成环状结构，并且包括该物质作为活性成分的用于预防和/或治疗中枢神经系统疾病和外周神经系统疾病的药物。
• DIPHENYLALKYLAMINE DERIVATIVES USEFUL AS OPIOID DELTA RECEPTOR AGONISTS
  申请人：Meiji Seika Kaisha, Ltd.

  公开号：EP1277737A1

  公开（公告）日：2003-01-22

  A substance having affinity for an opioid δ receptor, which is represented by the following general formula (I): wherein, X represents a group of the general formula: -CO-N(R5)(R6) (II) and the like, n represents 1 to 3, R1 and R2 represent a hydrogen atom, a halogen atom, a lower alkyl group and the like, R3 represents a hydrogen atom, a halogen atom, a lower alkyl group and the like, R4 represents a saturated or unsaturated monocyclic or bicyclic carbocyclic group and the like, R5 to R12 represent a hydrogen atom, a lower alkyl group and the like, and R3 and R4, R5 and R6, R7 or R8 and R9 and R10 may bind to each other to form a cyclic structure, and a medicament useful for preventive and/or therapeutic treatment of central nervous system diseases and peripheral nervous system diseases comprising the substance as an active ingredient.

  一种对阿片δ受体具有亲和力的物质，由以下通式(I)表示： 其中，X 代表通式中的基团：-R1 和 R2 代表氢原子、卤素原子、低级烷基等，R3 代表氢原子、卤素原子、低级烷基等，R4 代表饱和或不饱和的单环或双环碳环基团等，R5 至 R12 代表氢原子、低级烷基等、R3和R4、R5和R6、R7或R8以及R9和R10可以相互结合形成环状结构，以及一种用于预防和/或治疗中枢神经系统疾病和周围神经系统疾病的药物，该药物包含该物质作为活性成分。
• US6790854B2
  申请人：——

  公开号：US6790854B2

  公开（公告）日：2004-09-14