3,8-Diazabicyclo(3.2.1)octane-3-ethanol, 8-(3-(2-trifluoromethylphenothiazin-10-yl)propyl)-, dihydrochloride
CAS 5798-13-0 MFCD05798130
化学结构图
SMILES: Cl.Cl.OCCN1CC2CCC(C1)N2CCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21
化学属性
| Mol. Weight | 536.53 |
|---|---|
| Mol. Formula | C24H28F3N3OS.2ClH |
别名和识别编码
| Wiswesser Line Notation | T C666 BN ISJ EXFFF B- AT56 A AN GNTJ G2Q &GH 2 |
|---|---|
| Chemical Name | 3,8-Diazabicyclo(3.2.1)octane-3-ethanol, 8-(3-(2-trifluoromethylphenothiazin-10-yl)propyl)-, dihydrochloride |
| CAS Number | 5798-13-0 |
| InChIKey | FOXMORGBKWCORU-UHFFFAOYSA-N |
| PubChem Substance ID | 201307 |
| InChI | InChI=1S/C24H28F3N3OS.2ClH/c25-24(26,27)17-6-9-23-21(14-17)30(20-4-1-2-5-22(20)32-23)11-3-10-29-18-7-8-19(29)16-28(15-18)12-13-31;;/h1-2,4-6,9,14,18-19,31H,3,7-8,10-13,15-16H2;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 : 80 mg/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: 12,836,1969
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