393127-47-4 ((3-((1E)-N-(2-bromo-4,6-dinitrophenyl)ethanimidoyl)-4-hydroxy-1-phenylquinolin-2(1H)-one (en)2(1H)-Quinolinone, 3-[1-[(2-bromo-4,6-dinitrophenyl)imino]ethyl]-4-hydroxy-1-phenyl- (en))

CAS号:
393127-47-4
英文名称:
3-((1E)-N-(2-bromo-4,6-dinitrophenyl)ethanimidoyl)-4-hydroxy-1-phenylquinolin-2(1H)-one (en)2(1H)-Quinolinone, 3-[1-[(2-bromo-4,6-dinitrophenyl)imino]ethyl]-4-hydroxy-1-phenyl- (en)
分子式:
C23H15BrN4O6
分子量:
523.292404413223

3-((1E)-N-(2-bromo-4,6-dinitrophenyl)ethanimidoyl)-4-hydroxy-1-phenylquinolin-2(1H)-one (en)2(1H)-Quinolinone, 3-[1-[(2-bromo-4,6-dinitrophenyl)imino]ethyl]-4-hydroxy-1-phenyl- (en)(393127-47-4)名称与标识符

名称

英文别名:
3-((1E)-N-(2-bromo-4,6-dinitrophenyl)ethanimidoyl)-4-hydroxy-1-phenylquinolin-2(1H)-one (en)2(1H)-Quinolinone, 3-[1-[(2-bromo-4,6-dinitrophenyl)imino]ethyl]-4-hydroxy-1-phenyl- (en);(E)-3-(1-((2-bromo-4,6-dinitrophenyl)imino)ethyl)-4-hydroxy-1-phenylquinolin-2(1H)-one;2(1H)-Quinolinone, 3-[1-[(2-bromo-4,6-dinitrophenyl)imino]ethyl]-4-hydroxy-1-phenyl-;3-[N-(2-bromo-4,6-dinitrophenyl)-C-methylcarbonimidoyl]-4-hydroxy-1-phenylquinolin-2-one;AKOS004904031;393127-47-4;

标识符

MDL:
MFCD01102642
InChIKey:
AZBJSUWDROTVPJ-UHFFFAOYSA-N
Inchi:
1S/C23H15BrN4O6/c1-13(25-21-17(24)11-15(27(31)32)12-19(21)28(33)34)20-22(29)16-9-5-6-10-18(16)26(23(20)30)14-7-3-2-4-8-14/h2-12,29H,1H3
SMILES:
N1(C2=CC=CC=C2)C2=C(C=CC=C2)C(O)=C(C(=NC2=C([N+]([O-])=O)C=C([N+]([O-])=O)C=C2Br)C)C1=O

3-((1E)-N-(2-bromo-4,6-dinitrophenyl)ethanimidoyl)-4-hydroxy-1-phenylquinolin-2(1H)-one (en)2(1H)-Quinolinone, 3-[1-[(2-bromo-4,6-dinitrophenyl)imino]ethyl]-4-hydroxy-1-phenyl- (en)(393127-47-4)物化性质

计算特性

  • 精确分子量 : 522.01750Da
  • 氢键供体数量 : 1
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 5
  • 同位素质量 : 522.01750Da
  • 重原子数量 : 34
  • 复杂度 : 891
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 4.5
  • 拓扑分子极性表面积 : 145Ų

3-((1E)-N-(2-bromo-4,6-dinitrophenyl)ethanimidoyl)-4-hydroxy-1-phenylquinolin-2(1H)-one (en)2(1H)-Quinolinone, 3-[1-[(2-bromo-4,6-dinitrophenyl)imino]ethyl]-4-hydroxy-1-phenyl- (en)(393127-47-4)推荐厂家 更多厂家(1)

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