5-Norbornene-2,3-dicarboximide, N-(dimethylcarbamoylmethyl)-5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-, hydrate, endo- (1:1)

CAS 6434-38-4 MFCD06434384

化学结构图

6434-38-4
SMILES: CN(C)C(=O)CN1C(=O)C2C3C=C(C(O)(c4ccccc4)c4ccccn4)C(/C3=C(\c3ccccc3)c3ccccn3)C2C1=O

化学属性

Mol. Weight614.75
Mol. FormulaC37H32N4O4.H2O

别名和识别编码

Wiswesser Line NotationT C555 A AY DVNV IUTJ E1VN1&1 AUYR&- BT6NJ& IXQR&-BT6NJ &GH
Chemical Name5-Norbornene-2,3-dicarboximide, N-(dimethylcarbamoylmethyl)-5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-, hydrate, endo- (1:1)
CAS Number6434-38-4
InChIKeyKBNCEOBCRNFEAY-NVQSTNCTSA-N
PubChem Substance ID3038001
InChIInChI=1S/C37H32N4O4/c1-40(2)29(42)22-41-35(43)32-25-21-26(37(45,24-15-7-4-8-16-24)28-18-10-12-20-39-28)33(34(32)36(41)44)31(25)30(23-13-5-3-6-14-23)27-17-9-11-19-38-27/h3-21,25,32-34,45H,22H2,1-2H3/b31-30+
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安全信息

RTECSRB8400000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 5900 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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