5-Norbornene-2,3-dicarboximide, 5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-N-(2-pyridylmethyl)-, endo-

CAS 5014-11-9 MFCD N/A

化学结构图

5014-11-9
SMILES: O=C1C2C3C=C(C(O)(c4ccccc4)c4ccccn4)C(/C3=C(/c3ccccc3)c3ccccn3)C2C(=O)N1Cc1ccccn1

化学属性

Mol. Weight602.73
Mol. FormulaC39H30N4O3

别名和识别编码

Wiswesser Line NotationT C555 A AY DVNN IUTJ AUYR&- BT6NJ& E1- BT6NJ&IXQR&- BT6NJ ENDO
Chemical Name5-Norbornene-2,3-dicarboximide, 5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-N-(2-pyridylmethyl)-, endo-
Beilstein Registry Number0874513
CAS Number5014-11-9
InChIKeyJCOPYYJLEVRFMA-KARKAFJISA-N
PubChem Substance ID3037961
InChIInChI=1S/C39H30N4O3/c44-37-34-28-23-29(39(46,26-15-5-2-6-16-26)31-19-9-12-22-42-31)35(36(34)38(45)43(37)24-27-17-7-10-20-40-27)33(28)32(25-13-3-1-4-14-25)30-18-8-11-21-41-30/h1-23,28,34-36,46H,24H2/b33-32-
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安全信息

RTECSRB8870000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 5200 ug/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: 9,537,1966

系列性分类

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