1H-Imidazo[1,2-a][1,4]benzodiazepin-1-one,6-(2-chlorophenyl)-2,4-dihydro-2-[(4-methyl-1-piperazinyl)methylene]-8-nitro-,(2Z)-
- 中文别名：氯普唑仑
- 中文释义：氯普唑仑
- 英文别名：(2Z)-6-(2-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methylidene]-8-nitro-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one;
1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one,2,4-dihydro-6-(2-chlorophenyl)-2-((4-methyl-1-piperazinyl)methylene)-8-nitro;
(Z)-6-(o-Chlorophenyl)-2,4-dihydro-2-((4-methyl-1-piperazinyl)methylene)-8-nitro-1H-imidazo(1,2-a)(1,4)benzodiazepin-1-one;
Loprazolamum [INN-Latin];
6-o-chlorophenyl-2,4-dihydro-2-(4-methyl-1-piperazinyl)methylene-8-nitro-1H-imidazo<1,2-a><1,4>benzodiazepin-1-one;
Loprazolamum;
6-(2-chloro-phenyl)-2-(4-methyl-piperazin-1-ylmethylene)-8-nitro-2,4-dihydro-benzo[6,7]imidazo[1,2-a][1,4]diazepin-1-one;
6-(2-Chlorophenyl)-2,4-dihydro-2-((4-methyl-1-piperazinyl)methylene)-8-nitro-1H-imidazo(1,2-a) (1,4)benzodiazepin-1-one;
LOPRAZOLAM;
DEA No. 2773;
Triazulenone
- CAS No.：61197-73-7
- 分子式：
C23H21ClN6O3
- 分子量：0
- 精确分子量：464.13600
- PSA：97.33000
- InChI：The Key: UTEFBSAVJNEPTR-RGEXLXHISA-N
- 分子结构式：
物化性质
- 密度：
- 1.48g/cm3
- 沸点：
- 597.5ºC at 760 mmHg
- 闪点：
- 315.1ºC
- 折射率：
- 1.728
安全信息
- 密度：
- 1.48g/cm3
- 沸点：
- 597.5ºC at 760 mmHg
- 闪点：
- 315.1ºC
- 折射率：
- 1.728
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- NI2922476
- CHEMICAL NAME :
- 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-6-(2-chlorophenyl)-2-((4-methyl-1- piperazinyl)methylene)-8-nitro-
- CAS REGISTRY NUMBER :
- 61197-73-7
- LAST UPDATED :
- 199303
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C23-H21-Cl-N6-O3
- MOLECULAR WEIGHT :
- 464.95
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 20,1035,1977
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）:2.9
2.氢键供体数量:0
3.氢键受体数量:7
4.可旋转化学键数量:2
5.互变异构体数量:无
6.拓扑分子极性表面积:97.3
7.重原子数量:33
8.表面电荷:0
9.复杂度:891
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:0
13.确定化学键立构中心数量:1
14.不确定化学键立构中心数量:0
15.共价键单元数量:1
