3-Pyridineacrylic acid, 2-(4-(p-tolyl)-1-piperazinyl)ethyl ester

CAS 4415-55-8 MFCD N/A

化学结构图

4415-55-8
SMILES: Cc1ccc(N2CCN(CCOC(=O)/C=C/c3cccnc3)CC2)cc1

化学属性

Mol. Weight351.49
Mol. FormulaC21H25N3O2

别名和识别编码

Chemical Name3-Pyridineacrylic acid, 2-(4-(p-tolyl)-1-piperazinyl)ethyl ester
Synonym 2-Propenoic acid, 3-(3-pyridinyl)-, 1-Piperazineethanol, 4-(p-tolyl)-, 3-pyridineacrylate (ester)
Beilstein Registry Number0838804
CAS Number4415-55-8
PubChem Substance ID6444448
InChIInChI=1S/C21H25N3O2/c1-18-4-7-20(8-5-18)24-13-11-23(12-14-24)15-16-26-21(25)9-6-19-3-2-10-22-17-19/h2-10,17H,11-16H2,1H3/b9-6+
InChIKeyVKOHPEROCISETA-RMKNXTFCSA-N
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安全信息

RTECSUR9285000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 350 mg/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - effect, not otherwise specified
   Behavioral - changes in motor activity (specific assay)
   Behavioral - analgesia
REFERENCE :
   JPMSAE Journal of Pharmaceutical Sciences.  (American Pharmaceutical Assoc.,
   2215 Constitution Ave., NW, Washington, DC 20037)  V.50-    1961-
   Volume(issue)/page/year: 55,290,1966

系列性分类

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