ChemSpider 2D Image | N-(4-{2-[Benzyl(methyl)amino]-2-oxoethyl}phenyl)-N-(3-fluorobenzyl)-3-methylbutanamide | C28H31FN2O2

N-(4-{2-[Benzyl(methyl)amino]-2-oxoethyl}phenyl)-N-(3-fluorobenzyl)-3-methylbutanamide

  • Molecular FormulaC28H31FN2O2
  • Average mass446.556 Da
  • Monoisotopic mass446.236969 Da
  • ChemSpider ID22782617

More details:

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

Benzeneacetamide, 4-[[(3-fluorophenyl)methyl](3-methyl-1-oxobutyl)amino]-N-methyl-N-(phenylmethyl)- [ACD/Index Name]
N-(4-{2-[Benzyl(methyl)amino]-2-oxoethyl}phenyl)-N-(3-fluorbenzyl)-3-methylbutanamid [German] [ACD/IUPAC Name]
N-(4-{2-[Benzyl(methyl)amino]-2-oxoethyl}phenyl)-N-(3-fluorobenzyl)-3-methylbutanamide [ACD/IUPAC Name]
N-(4-{2-[Benzyl(méthyl)amino]-2-oxoéthyl}phényl)-N-(3-fluorobenzyl)-3-méthylbutanamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 607.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 321.3±31.5 °C
Index of Refraction: 1.591
Molar Refractivity: 130.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 5.03
ACD/BCF (pH 5.5): 3882.14
ACD/KOC (pH 5.5): 12901.79
ACD/LogD (pH 7.4): 5.03
ACD/BCF (pH 7.4): 3882.16
ACD/KOC (pH 7.4): 12901.88
Polar Surface Area: 41 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 386.8±3.0 cm3

Click to predict properties on the Chemicalize site


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