(+/-)-(4-oxo-2-pyrimidin-4-yl-4,6,7,8,9,10-hexahydro-pyrimido[1,2-a]azepin-10-ylmethyl)-carbamic acid benzyl ester | 1202639-47-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: (+/-)-(4-oxo-2-pyrimidin-4-yl-4,6,7,8,9,10-hexahydro-pyrimido[1,2-a]azepin-10-ylmethyl)-carbamic acid benzyl ester
• 英文别名: benzyl N-[(4-oxo-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)methyl]carbamate
• CAS: 1202639-47-1
• 化学式: C₂₂H₂₃N₅O₃
• 分子量: 405.456
• InChiKey: GGVBUGGNRNVPDE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  30
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  96.8
• 氢给体数：
  1
• 氢受体数：
  6

文献信息

• SUBSTITUTED PYRIMIDIN-4-ONE DERIVATIVES
  申请人：FAYOL Aude

  公开号：US20110144132A1

  公开（公告）日：2011-06-16

  A pyrimidone derivative represented by formula (I) or a salt thereof, or a solvate thereof or a hydrate thereof: wherein Y, R1, R2, R3, and R4 are as defined in the disclosure. Also disclosed are methods of preparing the compounds of formula (I), intermediates thereof and their use in therapeutics.

  一种由式(I)表示的吡啶酮衍生物或其盐、溶剂或水合物：其中Y，R1，R2，R3和R4如所述。还公开了制备式(I)化合物的方法，其中间体及其在治疗中的使用。
• [EN] SUBSTITUTED PYRIMIDIN-4-ONE DERIVATIVES<br/>[FR] DÉRIVÉS DE PYRIMIDIN-4-ONE SUBSTITUÉS
  申请人：MITSUBISHI TANABE PHARMA CORP

  公开号：WO2009156865A1

  公开（公告）日：2009-12-30

  A pyrimidone derivative represented by formula (I) or a salt thereof: wherein: Y represents two hydrogen atoms, a sulphur atom, an oxygen atom; R1 represents a 2, 3 or 4-pyridine ring or a 2, 4 or 5-pyrimidine ring, the ring being optionally substituted by a C1-6 alkyl group, a C1-6 alkoxy group or a halogen atom; R2 represents a hydrogen atom, a C1-6 alkyl group or a halogen atom; R3 represents a phenyl-group, a phenyl-CH2- group, a C1-6 alkyl-O-C(O)- group, a phenyl-C(O)- group, a 5-10 membered heterocyclic group, a phenyl-CH2-O-C(O)- group, a -C(O)-5-10 membered heterocyclic group, these groups being optionnally substituted by 1 to 4 substituents selected from a C1-6 alkyl group, a halogen atom, a C1-2 perhalogenated alkyl group, a C1-3 halogenated alkyl group, a hydroxyl group, a C1-6 alkoxy group, a C1-2 perhalogenated alkoxy group, a C1-6 alkylsulfonyl group, a nitro, a cyano, an amino, a C1-6 monoalkylamino group or a C2-12 dialkylamino-group, an acetoxy group, an aminosulfonyl group; R4 represents a hydrogen atom, a halogen atom, a hydroxyl group, a C1-6 alkyl group; m represents 0 to 2, in the form of a free base or of an addition salt with an acid.