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