ChemSpider 2D Image | 1'-[(1-Methyl-1H-imidazol-4-yl)sulfonyl]-4-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4'-bipiperidine | C20H26F3N5O3S

1'-[(1-Methyl-1H-imidazol-4-yl)sulfonyl]-4-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4'-bipiperidine

  • Molecular FormulaC20H26F3N5O3S
  • Average mass473.512 Da
  • Monoisotopic mass473.170837 Da
  • ChemSpider ID64931831

More details:

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

1'-[(1-Methyl-1H-imidazol-4-yl)sulfonyl]-4-{[5-(trifluormethyl)-2-pyridinyl]oxy}-1,4'-bipiperidin [German] [ACD/IUPAC Name]
1'-[(1-Methyl-1H-imidazol-4-yl)sulfonyl]-4-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4'-bipiperidine [ACD/IUPAC Name]
1'-[(1-Méthyl-1H-imidazol-4-yl)sulfonyl]-4-{[5-(trifluorométhyl)-2-pyridinyl]oxy}-1,4'-bipipéridine [French] [ACD/IUPAC Name]
Pyridine, 2-[[1'-[(1-methyl-1H-imidazol-4-yl)sulfonyl][1,4'-bipiperidin]-4-yl]oxy]-5-(trifluoromethyl)- [ACD/Index Name]
1'-[(1-methyl-1H-imidazol-4-yl)sulfonyl]-4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}-1,4'-bipiperidine
2097934-78-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 612.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 324.3±34.3 °C
Index of Refraction: 1.623
Molar Refractivity: 113.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.25
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 37.53
ACD/KOC (pH 7.4): 374.44
Polar Surface Area: 89 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 50.3±7.0 dyne/cm
Molar Volume: 322.0±7.0 cm3

Click to predict properties on the Chemicalize site


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