R,R-N-(1-phenylethyl)-N-1-acetyl-4-(2-chloro-4-fluorophenyl)-2-(2,4,6-trifluorophenyl)-6-methyl-1,4-dihydro-pyrimidin-5-carboxamide | 1005460-01-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: R,R-N-(1-phenylethyl)-N-1-acetyl-4-(2-chloro-4-fluorophenyl)-2-(2,4,6-trifluorophenyl)-6-methyl-1,4-dihydro-pyrimidin-5-carboxamide
• 英文别名: (4R)-1-acetyl-4-(2-chloro-4-fluorophenyl)-6-methyl-N-[(1R)-1-phenylethyl]-2-(2,4,6-trifluorophenyl)-4H-pyrimidine-5-carboxamide
• CAS: 1005460-01-4
• 化学式: C₂₈H₂₂ClF₄N₃O₂
• 分子量: 543.948
• InChiKey: LJMAZMQFXKNQEH-PTFIGZPYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  38
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  61.8
• 氢给体数：
  1
• 氢受体数：
  7

文献信息

• Dihydropyrimidine Compounds and Their Uses in Preparation of Medicaments for Treating and Preventing Antiviral Diseases
  申请人：Li Song

  公开号：US20100087448A1

  公开（公告）日：2010-04-08

  The present invention relates to a compound of formula (I) or a pharmaceutically acceptable salt or hydrate thereof, to a process for preparing the compound of formula (I), and to use of the compound of formula (I) or a pharmaceutically acceptable salt or hydrate thereof as a medicament, in particular as a medicament for the treatment and prevention of type B hepatitis.

  本发明涉及一种式（I）的化合物或其药学上可接受的盐或水合物，制备该式（I）化合物的方法，以及将该式（I）的化合物或其药学上可接受的盐或水合物用作药物，特别是用作治疗和预防乙型肝炎的药物。
• Optically Pure Dihydropyrimidine Compounds and Their Uses for the Preparation of a Medicament for Treatment and Prevention of Viral Diseases
  申请人：Li Song

  公开号：US20100004268A1

  公开（公告）日：2010-01-07

  The present invention relates to an optically pure compound of formula (I) or a pharmaceutically acceptable salt or hydrate thereof, a process for preparing the optically pure compound of formula (I), and use of the optically pure compound of formula (I) or a pharmaceutically acceptable salt or hydrate thereof as a medicament, in particular as a medicament for the treatment and prevention of type B hepatitis.

  本发明涉及公式(I)的光学纯化合物或其药学上可接受的盐或水合物，制备公式(I)的光学纯化合物的方法，以及将公式(I)的光学纯化合物或其药学上可接受的盐或水合物用作药物，特别是用作治疗和预防B型肝炎的药物。
• OPTICALLY PURE DIHYDROPYRIMIDINE COMPOUNDS AND THEIR USES FOR THE PREPARATION OF A MEDICAMENT FOR TREATMENT AND PREVENTION OF VIRAL DISEASES.
  申请人：Beijing Molecule Science and Technology Co., Ltd.

  公开号：EP2048141B1

  公开（公告）日：2017-06-14
• US8168642B2
  申请人：——

  公开号：US8168642B2

  公开（公告）日：2012-05-01
• US8329902B2
  申请人：——

  公开号：US8329902B2

  公开（公告）日：2012-12-11