Phenyl 7-methyl-6,8-dioxo-7,8-dihydro[1,4]benzodioxino[2,3-e]-pyrido[2',3':5,6][1,4]oxazino[3,2-g]isoindole-15(6H)-carboxylate | 680992-85-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶唑并吡啶类
• 英文名称: Phenyl 7-methyl-6,8-dioxo-7,8-dihydro[1,4]benzodioxino[2,3-e]-pyrido[2',3':5,6][1,4]oxazino[3,2-g]isoindole-15(6H)-carboxylate
• 英文别名: phenyl 7-methyl-6,8-dioxo-5b,6,7,8,8a,8b-hexahydro[1,4]benzodioxino-[2,3-e]pyrido[2',3':5,6][1,4]oxazino[3,2-g]isoindole-15(5aH)-carboxylate；Phenyl 14-methyl-13,15-dioxo-10,18,25-trioxa-3,5,14-triazahexacyclo[15.8.0.02,11.04,9.012,16.019,24]pentacosa-1(17),2(11),4(9),5,7,12(16),19,21,23-nonaene-3-carboxylate
• CAS: 680992-85-2
• 化学式: C₂₇H₁₅N₃O₇
• 分子量: 493.432
• InChiKey: LPEGAWGYVJIWAM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  37
• 可旋转键数：
  2
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  108
• 氢给体数：
  0
• 氢受体数：
  8

文献信息

• Novel substituted [1,4] benzodioxino[2,3-e] isoindole derivatives, method for preparing and pharmaceutical compositions containing same
  申请人：Coudert Gerard

  公开号：US20060040930A1

  公开（公告）日：2006-02-23

  Compounds of formula (I): wherein: A is as defined in the description, Y represents a group selected from an oxygen atom and a methylene group, R 2 represents a hydrogen atom and in that case: R 3 represents a group selected from a hydrogen atom and the groups linear or branched (C 1 -C 6 )alkyl, aryl, aryl-(C 1 -C 6 )alkyl (in which the alkyl moiety is linear or branched) and SO 2 CF 3 , or R 2 and R 3 form a bond, R 1 represents a group selected from a hydrogen atom and the groups linear or branched (C 1 -C 6 )alkyl, aryl and aryl-(C 1 -C 6 )alkyl (in which the alkyl moiety is linear or branched) or a linear or branched (C 1 -C 6 )alkylene chain, Z 1 and Z 2 each represent a hydrogen atom or Z 1 and Z 2 , together with the carbon atoms carrying them, form a phenyl group. Medicaments.

  式(I)的化合物：其中：A如描述中定义，Y代表从氧原子和亚甲基组中选择的一个基团，R2代表氢原子，此时：R3代表从氢原子和线性或支链的(C1-C6)烷基，芳基，芳基-(C1-C6)烷基（其中烷基基团是线性或支链的）和SO2CF3中选择的一个基团，或者R2和R3形成键，R1代表从氢原子和线性或支链的(C1-C6)烷基，芳基和芳基-(C1-C6)烷基（其中烷基基团是线性或支链的）或线性或支链的(C1-C6)烷基链中选择的一个基团，Z1和Z2各自代表氢原子或Z1和Z2与携带它们的碳原子一起形成苯基。药物。
• US7202255B2
  申请人：——

  公开号：US7202255B2

  公开（公告）日：2007-04-10