ChemSpider 2D Image | N-(2-{6-[(2-Ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-quinolinyl}phenyl)-1,1,1-trifluoromethanesulfonamide | C27H24F3N5O2S

N-(2-{6-[(2-Ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-quinolinyl}phenyl)-1,1,1-trifluoromethanesulfonamide

  • Molecular FormulaC27H24F3N5O2S
  • Average mass539.572 Da
  • Monoisotopic mass539.160278 Da
  • ChemSpider ID8134516

More details:

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

Methanesulfonamide, N-[2-[6-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-quinolinyl]phenyl]-1,1,1-trifluoro- [ACD/Index Name]
N-(2-{6-[(2-Ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-chinolinyl}phenyl)-1,1,1-trifluormethansulfonamid [German] [ACD/IUPAC Name]
N-(2-{6-[(2-Éthyl-5,7-diméthyl-3H-imidazo[4,5-b]pyridin-3-yl)méthyl]-2-quinoléinyl}phényl)-1,1,1-trifluorométhanesulfonamide [French] [ACD/IUPAC Name]
N-(2-{6-[(2-Ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-quinolinyl}phenyl)-1,1,1-trifluoromethanesulfonamide [ACD/IUPAC Name]
ga01-13

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

Density: 1.4±0.1 g/cm3
Boiling Point: 691.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.3±3.0 kJ/mol
Flash Point: 372.1±34.3 °C
Index of Refraction: 1.645
Molar Refractivity: 139.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.44
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 287.33
ACD/KOC (pH 5.5): 469.08
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 463.50
ACD/KOC (pH 7.4): 756.68
Polar Surface Area: 98 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 47.2±7.0 dyne/cm
Molar Volume: 385.4±7.0 cm3

Click to predict properties on the Chemicalize site


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