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Substance Name: (1,1'-Biphenyl)-4-butanamide, 2',4'-difluoro-alpha-methyl-gamma-oxo-N-(1-phenylethyl)-, (R-(R*,S*))-
RN: 161692-87-1
InChIKey: IRODEYFFQWPTPR-DLBZAZTESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H23-F2-N-O2

Molecular Weight

  • 407.4577
 
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Names and Synonyms

Synonym

  • R-(+)-1-Phenylethylamide of 4-(2',4'-difluorobiphenyl-4-yl)-2-methyl-4-oxobutanoic acid

Systematic Name

  • (1,1'-Biphenyl)-4-butanamide, 2',4'-difluoro-alpha-methyl-gamma-oxo-N-(1-phenylethyl)-, (R-(R*,S*))-

Registry Numbers

CAS Registry Number

  • 161692-87-1

System Generated Number

  • 0161692871

Structure Descriptors

InChI

1S/C25H23F2NO2/c1-16(25(30)28-17(2)18-6-4-3-5-7-18)14-24(29)20-10-8-19(9-11-20)22-13-12-21(26)15-23(22)27/h3-13,15-17H,14H2,1-2H3,(H,28,30)/t16-,17+/m0/s1

InChIKey

IRODEYFFQWPTPR-DLBZAZTESA-N

Smiles

C[C@@H](CC(=O)c1ccc(cc1)c2ccc(cc2F)F)C(=O)N[C@H](C)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 500mg/kg (500mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 59, Pg. 2705, 1994.