ChemSpider 2D Image | N-[(1-Cyclopropyl-2-{[3-(trifluoromethyl)benzyl]sulfonyl}-1H-imidazol-5-yl)methyl]-N-ethyl-2-thiophenecarboxamide | C22H22F3N3O3S2

N-[(1-Cyclopropyl-2-{[3-(trifluoromethyl)benzyl]sulfonyl}-1H-imidazol-5-yl)methyl]-N-ethyl-2-thiophenecarboxamide

  • Molecular FormulaC22H22F3N3O3S2
  • Average mass497.554 Da
  • Monoisotopic mass497.105469 Da
  • ChemSpider ID22609196

More details:

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

2-Thiophenecarboxamide, N-[[1-cyclopropyl-2-[[[3-(trifluoromethyl)phenyl]methyl]sulfonyl]-1H-imidazol-5-yl]methyl]-N-ethyl- [ACD/Index Name]
N-[(1-Cyclopropyl-2-{[3-(trifluormethyl)benzyl]sulfonyl}-1H-imidazol-5-yl)methyl]-N-ethyl-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-[(1-Cyclopropyl-2-{[3-(trifluoromethyl)benzyl]sulfonyl}-1H-imidazol-5-yl)methyl]-N-ethyl-2-thiophenecarboxamide [ACD/IUPAC Name]
N-[(1-Cyclopropyl-2-{[3-(trifluorométhyl)benzyl]sulfonyl}-1H-imidazol-5-yl)méthyl]-N-éthyl-2-thiophènecarboxamide [French] [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: 672.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.8±3.0 kJ/mol
Flash Point: 360.4±34.3 °C
Index of Refraction: 1.635
Molar Refractivity: 123.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 226.05
ACD/KOC (pH 5.5): 1685.57
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 226.05
ACD/KOC (pH 7.4): 1685.57
Polar Surface Area: 109 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 343.9±7.0 cm3

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