Butyrophenone, 4'-fluoro-4-(9-methyl-3-azaspiro(5.5)undec-3-yl)-
CAS 64-59-5 MFCD00064595
化学结构图
SMILES: CC1CCC2(CC1)CC[NH+](CCCC(=O)c1ccc(F)cc1)CC2.[Cl-]
化学属性
| Mol. Formula | C21H30FNO |
|---|---|
| Mol. Weight | 331.52 |
别名和识别编码
| Wiswesser Line Notation | T6N DXTJ A3VR DF& D-& AL6XTJ D1 |
|---|---|
| Chemical Name | Butyrophenone, 4'-fluoro-4-(9-methyl-3-azaspiro(5.5)undec-3-yl)- |
| Synonym | 4'-Fluoro-4-(9-methyl-3-azaspiro(5.5)undec-3-yl)butyrophenone |
| CAS Number | 64-59-5 |
| Beilstein Registry Number | 1348999 |
| InChIKey | ADPMIFYDMCNJNN-UHFFFAOYSA-N |
| PubChem Substance ID | 6155 |
| InChI | InChI=1S/C21H30FNO.ClH/c1-17-8-10-21(11-9-17)12-15-23(16-13-21)14-2-3-20(24)18-4-6-19(22)7-5-18;/h4-7,17H,2-3,8-16H2,1H3;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 - rat DOSE/DURATION : 75 mg/kg TOXIC EFFECTS : Behavioral - somnolence (general depressed activity) Behavioral - ataxia Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation 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: 8,62,1965
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