ChemSpider 2D Image | N-[2-(2-Chloro-6-fluorophenoxy)-6-(1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-4-pyrimidinyl]-4,4,4-trifluoro-1-butanesulfonamide | C20H17ClF4N4O4S

N-[2-(2-Chloro-6-fluorophenoxy)-6-(1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-4-pyrimidinyl]-4,4,4-trifluoro-1-butanesulfonamide

  • Molecular FormulaC20H17ClF4N4O4S
  • Average mass520.885 Da
  • Monoisotopic mass520.059509 Da
  • ChemSpider ID128985768

More details:

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

1-Butanesulfonamide, N-[2-(2-chloro-6-fluorophenoxy)-6-(1,6-dihydro-1-methyl-6-oxo-3-pyridinyl)-4-pyrimidinyl]-4,4,4-trifluoro- [ACD/Index Name]
N-[2-(2-Chlor-6-fluorphenoxy)-6-(1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-4-pyrimidinyl]-4,4,4-trifluor-1-butansulfonamid [German] [ACD/IUPAC Name]
N-[2-(2-Chloro-6-fluorophenoxy)-6-(1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-4-pyrimidinyl]-4,4,4-trifluoro-1-butanesulfonamide [ACD/IUPAC Name]
N-[2-(2-Chloro-6-fluorophénoxy)-6-(1-méthyl-6-oxo-1,6-dihydro-3-pyridinyl)-4-pyrimidinyl]-4,4,4-trifluoro-1-butanesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 669.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.4±3.0 kJ/mol
Flash Point: 358.7±34.3 °C
Index of Refraction: 1.583
Molar Refractivity: 114.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.47
ACD/LogD (pH 7.4): 0.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.43
Polar Surface Area: 110 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 342.4±3.0 cm3

Click to predict properties on the Chemicalize site


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