8-(1-Methyl-4-piperidyl)theophylline hydrochloride

CAS 964-56-7 MFCD01682207

化学结构图

964-56-7
SMILES: CN1CCC(c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)CC1.Cl

化学属性

Mol. FormulaC13H19N5O2.ClH
Mol. Weight313.83

别名和识别编码

Chemical NameTheophylline, 8-(1-methyl-4-piperidyl)-, hydrochloride
InChIKeyHQIAWTXPQSYAPS-UHFFFAOYSA-N
Wiswesser Line NotationT56 BN DN FVNVNJ C- DT6NTJ A1& G1 I1 &GH
Synonym Chlorhydrate de N methyl piperidyl-4' theophylline 8-(1-Methyl-4-piperidyl)theophylline hydrochloride
CAS Number964-56-7
PubChem Substance ID120487
InChIInChI=1S/C13H19N5O2.ClH/c1-16-6-4-8(5-7-16)10-14-9-11(15-10)17(2)13(20)18(3)12(9)19;/h8H,4-7H2,1-3H3,(H,14,15);1H
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安全信息

RTECSXH6136000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1018 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   APFRAD Annales Pharmaceutiques Francaises.  (SPPIF, B.P.22, F-41353 Vineuil,
   France)  V.1-    1943-  Volume(issue)/page/year: 22,265,1964

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 337 mg/kg
TOXIC EFFECTS :
   Behavioral - excitement
   Behavioral - changes in motor activity (specific assay)
REFERENCE :
   APFRAD Annales Pharmaceutiques Francaises.  (SPPIF, B.P.22, F-41353 Vineuil,
   France)  V.1-    1943-  Volume(issue)/page/year: 22,265,1964

系列性分类

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