2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-1-(2-(dimethylamino)ethyl)-5-phenyl-7-(trifluoromethyl)-, dihydrochloride
CAS 1959-19-9 MFCD01959199
化学结构图
SMILES: C[NH+](C)CCN1C(=O)C[NH+]=C(c2ccccc2)c2cc(C(F)(F)F)ccc21.[Cl-].[Cl-]
化学属性
| Mol. Weight | 448.35 |
|---|---|
| Mol. Formula | C20H20F3N3O.2ClH |
别名和识别编码
| Wiswesser Line Notation | T67 GNV JN IHJ CXFFF G2N1&1 KR &GH 2 |
|---|---|
| Chemical Name | 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-1-(2-(dimethylamino)ethyl)-5-phenyl-7-(trifluoromethyl)-, dihydrochloride |
| CAS Number | 1959-19-9 |
| InChIKey | PSUPORXCGKAVFW-UHFFFAOYSA-N |
| PubChem Substance ID | 16062 |
| InChI | InChI=1S/C20H20F3N3O.2ClH/c1-25(2)10-11-26-17-9-8-15(20(21,22)23)12-16(17)19(24-13-18(26)27)14-6-4-3-5-7-14;;/h3-9,12H,10-11,13H2,1-2H3;2*1H |
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安全信息
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 280 mg/kg TOXIC EFFECTS : Autonomic Nervous System - smooth muscle relaxant (mechanism undefined, spasmolytic) Behavioral - anticonvulsant Behavioral - somnolence (general depressed activity) 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: 8,815,1965
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