Benzoic acid, 4-((2,4-diamino-6-(3-anilino)propylamino)pyrimidin-5-yl)azo-, ethyl ester

CAS 7313-47-5 MFCD N/A

化学结构图

7313-47-5
SMILES: CCOC(=O)c1ccc(N=Nc2c(N)nc(N)nc2NCCCNc2ccccc2)cc1

化学属性

Mol. Weight434.56
Mol. FormulaC22H26N8O2

别名和识别编码

Chemical NameBenzoic acid, 4-((2,4-diamino-6-(3-anilino)propylamino)pyrimidin-5-yl)azo-, ethyl ester
Chemicalbook IDCB32253025
Wiswesser Line NotationT6N CNJ BZ DZ ENUNR DVO2& FM3MR
Synonym 4-((2,4-Diamino-6-(3-anilino)propylamino)pyrimidin-5-yl)azobenzoic acid
CAS Number7313-47-5
InChIKeyOMXYZQOYLZPDMU-QVIHXGFCSA-N
PubChem Substance ID23735
InChIInChI=1S/C22H26N8O2/c1-2-32-21(31)15-9-11-17(12-10-15)29-30-18-19(23)27-22(24)28-20(18)26-14-6-13-25-16-7-4-3-5-8-16/h3-5,7-12,25H,2,6,13-14H2,1H3,(H5,23,24,26,27,28)
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安全信息

RTECSDG6230000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 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: 9,874,1966

系列性分类

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