ChemSpider 2D Image | N-{1-[1-(4-Fluorophenyl)-5-methyl-1H-pyrazol-4-yl]ethyl}-2-{[5-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetamide | C20H18F4N4OS

N-{1-[1-(4-Fluorophenyl)-5-methyl-1H-pyrazol-4-yl]ethyl}-2-{[5-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetamide

  • Molecular FormulaC20H18F4N4OS
  • Average mass438.442 Da
  • Monoisotopic mass438.113739 Da
  • ChemSpider ID33650799

More details:

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

Acetamide, N-[1-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-4-yl]ethyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]- [ACD/Index Name]
N-{1-[1-(4-Fluorophenyl)-5-methyl-1H-pyrazol-4-yl]ethyl}-2-{[5-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetamide [ACD/IUPAC Name]
N-{1-[1-(4-Fluorophényl)-5-méthyl-1H-pyrazol-4-yl]éthyl}-2-{[5-(trifluorométhyl)-2-pyridinyl]sulfanyl}acétamide [French] [ACD/IUPAC Name]
N-{1-[1-(4-Fluorphenyl)-5-methyl-1H-pyrazol-4-yl]ethyl}-2-{[5-(trifluormethyl)-2-pyridinyl]sulfanyl}acetamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 582.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.2±30.1 °C
Index of Refraction: 1.592
Molar Refractivity: 108.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 500.65
ACD/KOC (pH 5.5): 2978.00
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 500.66
ACD/KOC (pH 7.4): 2978.09
Polar Surface Area: 85 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 40.9±7.0 dyne/cm
Molar Volume: 320.8±7.0 cm3

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