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3,5-Pyridinedicarboxylicacid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-,3-[2-[4-(diphenylmethyl)-1-piperazinyl]ethyl] 5-methyl ester

3,5-Pyridinedicarboxylicacid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-,3-[2-[4-(diphenylmethyl)-1-piperazinyl]ethyl] 5-methyl ester


  • 中文别名:马尼地平
  • 中文释义:马尼地平;2-(4-(二苯基甲基)-1-哌嗪基)乙基 甲基 2,6-二甲基-4-(3-硝基苯基)-1,4-二氢吡啶-3,5-二羧酸酯;1,4-二氢-2,6-二甲基-4-间硝基苯基-3,5-吡啶二羧酸甲酯2-(4-二苯甲基-1-哌嗪基)乙酯
  • 英文别名:3-(2-(4-Benzhydrylpiperazin-1-yl)ethyl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;
    2-(4-Diphenylmethyl-1-piperazinyl)ethyl methyl-1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate;
    Manidipine (Manyper);
    2-(4-(Diphenylmethyl)-1-piperazinyl)ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;
    Franidipine;
    Manidipine;
    Manidipine 6300;
    MANIDIPINE: MANIDIPINE DIHYDROCHLORIDE;
    1-diphenylmethyl-4-(2-hydroxyethyl)piperazine;
    CV-4093,2-(4-diphenylmethyl-1-piperazinyl)ethyl methyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate;
    2-(4-benzhydryl-1-piperazinyl)ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;
    (+/-)-1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-[4-(diphenylmethyl)-1-piperazinyl]ethyl methyl ester;
    3-{2-[4-(diphenylMethyl)piperazin-1-yl]ethyl} 5-Methyl 2,6-diMethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate 
  • CAS No.:89226-50-6
  • 分子式:

    C35H38N4O6

  • 分子量:610.70
  • 精确分子量:610.27900
  • PSA:116.93000
  • InChI:The Key: ANEBWFXPVPTEET-UHFFFAOYSA-N
  • 分子结构式:

物化性质

密度:
1.232 g/cm3
熔点:
125-128ºC
沸点:
722ºC at 760 mmHg
闪点:
390.4ºC
其它信息:

1.性状:从异丙醚-己烷得淡黄色结晶。

2.熔点(℃):125-128。

安全信息

密度:
1.232 g/cm3
熔点:
125-128ºC
沸点:
722ºC at 760 mmHg
闪点:
390.4ºC
其它信息:

1.性状:从异丙醚-己烷得淡黄色结晶。

2.熔点(℃):125-128。

分子结构与计算化学数据

计算化学数据

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:1

3.氢键受体数量:9

4.可旋转化学键数量:11

5.互变异构体数量:5

6.拓扑分子极性表面积117

7.重原子数量:45

8.表面电荷:0

9.复杂度:1090

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:1

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

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