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Search term: LRPFOJAUXAMOQR-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-Butyl-5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methylbenzamide | C20H21FN4O4

N-Butyl-5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methylbenzamide

  • Molecular FormulaC20H21FN4O4
  • Average mass400.404 Da
  • Monoisotopic mass400.154694 Da
  • ChemSpider ID76726147

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Benzamide, N-butyl-5-[4-(2-fluorophenyl)-4,5-dihydro-5-oxo-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methyl- [ACD/Index Name]
N-Butyl-5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methylbenzamide [ACD/IUPAC Name]
N-Butyl-5-[4-(2-fluorophényl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-méthylbenzamide [French] [ACD/IUPAC Name]
N-Butyl-5-[4-(2-fluorphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methylbenzamid [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.636
Molar Refractivity: 104.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.24
ACD/LogD (pH 5.5): 0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.87
ACD/LogD (pH 7.4): -0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.65
Polar Surface Area: 105 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 290.1±7.0 cm3

Click to predict properties on the Chemicalize site


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