2H-1,4-Benzodiazepin-2-one, 1,3,4,5-tetrahydro-7-chloro-1-(2-(diethylamino)ethyl)-5-(o-fluorophenyl)-, dihydrochloride
CAS 1972-74-3 MFCD01972743
化学结构图
SMILES: CC[NH+](CC)CCN1C(=O)C[NH2+]C(c2ccccc2F)c2cc(Cl)ccc21.[Cl-].[Cl-]
化学属性
| Mol. Weight | 462.86 |
|---|---|
| Mol. Formula | C21H25ClFN3O.2ClH |
别名和识别编码
| Wiswesser Line Notation | T67 GNV JM&TJ CG G2N2&2 KR BF &GH 2 |
|---|---|
| Chemical Name | 2H-1,4-Benzodiazepin-2-one, 1,3,4,5-tetrahydro-7-chloro-1-(2-(diethylamino)ethyl)-5-(o-fluorophenyl)-, dihydrochloride |
| CAS Number | 1972-74-3 |
| InChIKey | XNKXLMDFIPIZOB-UHFFFAOYSA-N |
| PubChem Substance ID | 16079 |
| InChI | InChI=1S/C21H25ClFN3O.2ClH/c1-3-25(4-2)11-12-26-19-10-9-15(22)13-17(19)21(24-14-20(26)27)16-7-5-6-8-18(16)23;;/h5-10,13,21,24H,3-4,11-12,14H2,1-2H3;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 : 305 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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