ChemSpider 2D Image | N-Benzyl-2-({(2-methoxybenzyl)[3-(trifluoromethyl)benzyl]amino}methyl)-N-methyl-1,3-oxazole-4-carboxamide | C29H28F3N3O3

N-Benzyl-2-({(2-methoxybenzyl)[3-(trifluoromethyl)benzyl]amino}methyl)-N-methyl-1,3-oxazole-4-carboxamide

  • Molecular FormulaC29H28F3N3O3
  • Average mass523.546 Da
  • Monoisotopic mass523.208252 Da
  • ChemSpider ID22675458

More details:

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

4-Oxazolecarboxamide, 2-[[[(2-methoxyphenyl)methyl][[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-methyl-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-2-({(2-methoxybenzyl)[3-(trifluormethyl)benzyl]amino}methyl)-N-methyl-1,3-oxazol-4-carboxamid [German] [ACD/IUPAC Name]
N-Benzyl-2-({(2-methoxybenzyl)[3-(trifluoromethyl)benzyl]amino}methyl)-N-methyl-1,3-oxazole-4-carboxamide [ACD/IUPAC Name]
N-Benzyl-2-({(2-méthoxybenzyl)[3-(trifluorométhyl)benzyl]amino}méthyl)-N-méthyl-1,3-oxazole-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 599.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 316.4±30.1 °C
Index of Refraction: 1.576
Molar Refractivity: 138.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 4.48
ACD/BCF (pH 5.5): 1330.41
ACD/KOC (pH 5.5): 5206.98
ACD/LogD (pH 7.4): 4.69
ACD/BCF (pH 7.4): 2166.15
ACD/KOC (pH 7.4): 8477.92
Polar Surface Area: 59 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 416.9±3.0 cm3

Click to predict properties on the Chemicalize site


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