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Substance Name: CG 21
RN: 3614-68-4
InChIKey: ZYPMQWFBSVRHCF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-N2-O3.C13-H14-N2-O

Molecular Weight

  • 538.645
 
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Names and Synonyms

Results Name

  • CG 21

Synonym

  • CG 21

Systematic Name

  • 3-Pyrazolin-5-one, 4-butyl-3-hydroxy-1-(p-hydroxyphenyl)-2-phenyl-, compd. with alpha-((2-pyridylamino)methyl)benzyl alcohol (1:1)

Registry Numbers

CAS Registry Number

  • 3614-68-4

System Generated Number

  • 0003614684

Molecular Formulas

Molecular Formula

  • C19-H20-N2-O3.C13-H14-N2-O

Molecular Formula Fragments

  • C13-H14-N2-O
  • C19-H20-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C19H20N2O3.C13H14N2O/c1-2-3-9-17-18(23)20(14-7-5-4-6-8-14)21(19(17)24)15-10-12-16(22)13-11-15;16-12(11-6-2-1-3-7-11)10-15-13-8-4-5-9-14-13/h4-8,10-13,22-23H,2-3,9H2,1H3;1-9,12,16H,10H2,(H,14,15)

InChIKey

ZYPMQWFBSVRHCF-UHFFFAOYSA-N

Smiles

c1([C@@H](CNc2ccccn2)O)ccccc1.n1(n(c(c(c1=O)CCCC)O)c1ccccc1)c1ccc(cc1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 550mg/kg (550mg/kg)   Bollettino Chimico Farmaceutico. Vol. 103, Pg. 245, 1964.
rat LD50 oral 1450mg/kg (1450mg/kg)   Bollettino Chimico Farmaceutico. Vol. 103, Pg. 245, 1964.