2H-1,4-Benzodiazepin-2-one, 1,3,4,5-tetrahydro-7-chloro-1-(3-(diethylamino)propyl)-5-(o-fluorophenyl)-, dihydrochloride

CAS 4084-17-7 MFCD04084177

化学结构图

4084-17-7
SMILES: CC[NH+](CC)CCCN1C(=O)C[NH2+]C(c2ccccc2F)c2cc(Cl)ccc21.[Cl-].[Cl-]

化学属性

Mol. Weight476.89
Mol. FormulaC22H27ClFN3O.2ClH

别名和识别编码

Wiswesser Line NotationT67 GNV JM&TJ CG G3N2&2 KR BF &GH 2
Chemical Name2H-1,4-Benzodiazepin-2-one, 1,3,4,5-tetrahydro-7-chloro-1-(3-(diethylamino)propyl)-5-(o-fluorophenyl)-, dihydrochloride
CAS Number4084-17-7
InChIKeyQEUKBYHCAKPCFT-UHFFFAOYSA-N
PubChem Substance ID20022
InChIInChI=1S/C22H27ClFN3O.2ClH/c1-3-26(4-2)12-7-13-27-20-11-10-16(23)14-18(20)22(25-15-21(27)28)17-8-5-6-9-19(17)24;;/h5-6,8-11,14,22,25H,3-4,7,12-13,15H2,1-2H3;2*1H
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安全信息

RTECSDF2705300
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

系列性分类


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