ChemSpider 2D Image | N-(4-Fluorobenzyl)-2-{[(4-fluorobenzyl)(3-phenoxybenzyl)amino]methyl}-1,3-oxazole-4-carboxamide | C32H27F2N3O3

N-(4-Fluorobenzyl)-2-{[(4-fluorobenzyl)(3-phenoxybenzyl)amino]methyl}-1,3-oxazole-4-carboxamide

  • Molecular FormulaC32H27F2N3O3
  • Average mass539.572 Da
  • Monoisotopic mass539.202026 Da
  • ChemSpider ID22674513

More details:

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

4-Oxazolecarboxamide, N-[(4-fluorophenyl)methyl]-2-[[[(4-fluorophenyl)methyl][(3-phenoxyphenyl)methyl]amino]methyl]- [ACD/Index Name]
N-(4-Fluorbenzyl)-2-{[(4-fluorbenzyl)(3-phenoxybenzyl)amino]methyl}-1,3-oxazol-4-carboxamid [German] [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-2-{[(4-fluorobenzyl)(3-phenoxybenzyl)amino]methyl}-1,3-oxazole-4-carboxamide [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-2-{[(4-fluorobenzyl)(3-phénoxybenzyl)amino]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: 692.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.4±3.0 kJ/mol
Flash Point: 372.4±31.5 °C
Index of Refraction: 1.616
Molar Refractivity: 148.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 5.73
ACD/BCF (pH 5.5): 12253.84
ACD/KOC (pH 5.5): 26700.41
ACD/LogD (pH 7.4): 5.87
ACD/BCF (pH 7.4): 17059.06
ACD/KOC (pH 7.4): 37170.71
Polar Surface Area: 68 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 423.5±3.0 cm3

Click to predict properties on the Chemicalize site


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