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Substance Name: Benzenepentanoic acid, delta-oxo-gamma-phenyl-gamma-(2-pyridinylamino)-
RN: 63779-60-2
InChIKey: XMDYVICDFPVNLS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H20-N2-O3

Molecular Weight

  • 360.411
 
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Names and Synonyms

Synonyms

  • 5-22-08-00374 (Beilstein Handbook Reference)
  • Acide oxo-5 (pyridylamino-2)-4 diphenyl-4,5 pentanoique
  • Acide oxo-5 (pyridylamino-2)-4 diphenyl-4,5 pentanoique [French]
  • BRN 0442461
  • delta-Oxo-gamma-phenyl-gamma-(2-pyridinylamino)benzenepentanoic acid
  • Valeric acid, 4,5-diphenyl-5-oxo-4-(2-pyridinylamino)-

Systematic Name

  • Benzenepentanoic acid, delta-oxo-gamma-phenyl-gamma-(2-pyridinylamino)-

Registry Numbers

CAS Registry Number

  • 63779-60-2

System Generated Number

  • 0063779602

Structure Descriptors

InChI

1S/C22H20N2O3/c25-20(26)14-15-22(18-11-5-2-6-12-18,24-19-13-7-8-16-23-19)21(27)17-9-3-1-4-10-17/h1-13,16H,14-15H2,(H,23,24)(H,25,26)

InChIKey

XMDYVICDFPVNLS-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(=O)C(CCC(=O)O)(c2ccccc2)Nc3ccccn3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 3gm/kg (3000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 285, 1977.