1,4-dihydro-2,6-dimethyl-4-[5-[[3-(4-cyclohexyl-1-piperazinyl)propyl]amino]-5-oxopentyl]-3,5-pyridine dicarboxylic acid, dimethyl ester | 372963-28-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 1,4-dihydro-2,6-dimethyl-4-[5-[[3-(4-cyclohexyl-1-piperazinyl)propyl]amino]-5-oxopentyl]-3,5-pyridine dicarboxylic acid, dimethyl ester
• 英文别名: 1,4-Dihydro-2,6-dimethyl-4-[5-[[3-(4-cyclohexyl-1-piperazinyl) propyl]amino]-5-oxopentyl]-3,5-pyridine dicarboxylic acid, dimethyl ester；dimethyl 4-[5-[3-(4-cyclohexylpiperazin-1-yl)propylamino]-5-oxopentyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
• CAS: 372963-28-5
• 化学式: C₂₉H₄₈N₄O₅
• 分子量: 532.724
• InChiKey: PQSCOAOKCVKOFU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  38
• 可旋转键数：
  14
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  100
• 氢给体数：
  2
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  1,4-Dihydro-2,6-dimethyl-4-(5-hydroxy-5-oxopentyl)-3,5-pyridine Dicarboxylic Acid 、 3-(4-cyclohexylpiperazin-1-yl)propan-1-amine 生成 1,4-dihydro-2,6-dimethyl-4-[5-[[3-(4-cyclohexyl-1-piperazinyl)propyl]amino]-5-oxopentyl]-3,5-pyridine dicarboxylic acid, dimethyl ester
  参考文献：
  名称：

  US2001/49370

  摘要：

  公开号：

文献信息

• 4-Alkyl and 4-cycloalkyl derivatives of dihydropyridine NPY antagonists
  申请人：——

  公开号：US20010049370A1

  公开（公告）日：2001-12-06

  A series of non-peptidergic antagonists of NPY have been synthesized and are comprised of 4-alkyl and cycloalkyl derivatives of dihydropyridines of Formula I. 1 X=—NH— or a covalent bond A=alkyl, cycloalkyl As antagonists of NPY-induced behavior, these compounds are expected to act as effective anorexiant agents in promoting weight loss and treating eating disorders.

  一系列非肽类NPY拮抗剂已被合成，由公式I的二氢吡啶的4-烷基和环烷基衍生物组成，其中1X==—NH—或共价键A==烷基，环烷基。这些化合物作为NPY诱导行为的拮抗剂，预计可作为有效的食欲抑制剂，促进减重和治疗进食障碍。
• 4-alkyl and 4-cycloalkyl derivatives of dihydropyridine NPY antagonists
  申请人：Bristol-Myers Squibb Company

  公开号：US06444675B2

  公开（公告）日：2002-09-03

  A series of non-peptidergic antagonists of NPY have been synthesized and are comprised of 4-alkyl and cycloalkyl derivatives of dihydropyridines of Formula I. As antagonists of NPY-induced behavior, these compounds are expected to act as effective anorexiant agents in promoting weight loss and treating eating disorders.

  一系列非肽类的NPY拮抗剂已经合成，包括公式I的二氢吡啶的4-烷基和环烷基衍生物。作为NPY诱导行为的拮抗剂，这些化合物预计将作为有效的抑制食欲剂，促进减重并治疗进食障碍。