1-Piperazineethanol,4-(o-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthinylmethyl)-, benzoate (ester)

CAS 19977-11-8 MFCD01702879

化学结构图

19977-11-8
SMILES: CN1C(=O)C2=C(N=CN2CC(CN2CCN(CC3=CC=CC=C3Cl)CC2)OC(=O)C2C=CC=CC=2)N(C)C1=O

化学属性

Mol. FormulaC28H31ClN6O4
Mol. Weight551.10

别名和识别编码

Chemical Name1-Piperazineethanol,4-(o-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthinylmethyl)-, benzoate (ester)
Wiswesser Line NotationT56 BN DN FNVNVJ F1 H1 B1YR BG&- AT6N DNTJ D2OVR
Synonym 7-(2-Benzoyloxy-3-(4-(o-chlorobenzyl)-1-piperazinyl)propyl)theophylline Theophylline,
CAS Number19977-11-8
Beilstein Registry Number0601417
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安全信息

RTECSTL6973000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 84 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - excitement
REFERENCE :
   YKKZAJ Yakugaku Zasshi.  Journal of Pharmacy.  (Nippon Yakugakkai, 2-12-15
   Shibuya, Shibuya-ku, Tokyo 150, Japan)  No.1-    1881-
   Volume(issue)/page/year: 89,771,1969

系列性分类

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