ChemSpider 2D Image | 1-[(1-Cyclopropyl-2-{[3-(trifluoromethyl)benzyl]sulfonyl}-1H-imidazol-5-yl)methyl]-3-ethyl-1-isobutylurea | C22H29F3N4O3S

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

  • Molecular FormulaC22H29F3N4O3S
  • Average mass486.551 Da
  • Monoisotopic mass486.191254 Da
  • ChemSpider ID22638820

More details:

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

1-[(1-Cyclopropyl-2-{[3-(trifluormethyl)benzyl]sulfonyl}-1H-imidazol-5-yl)methyl]-3-ethyl-1-isobutylharnstoff [German] [ACD/IUPAC Name]
1-[(1-Cyclopropyl-2-{[3-(trifluoromethyl)benzyl]sulfonyl}-1H-imidazol-5-yl)methyl]-3-ethyl-1-isobutylurea [ACD/IUPAC Name]
1-[(1-Cyclopropyl-2-{[3-(trifluorométhyl)benzyl]sulfonyl}-1H-imidazol-5-yl)méthyl]-3-éthyl-1-isobutylurée [French] [ACD/IUPAC Name]
Urea, N-[[1-cyclopropyl-2-[[[3-(trifluoromethyl)phenyl]methyl]sulfonyl]-1H-imidazol-5-yl]methyl]-N'-ethyl-N-(2-methylpropyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.582
Molar Refractivity: 120.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 277.35
ACD/KOC (pH 5.5): 1951.30
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 277.35
ACD/KOC (pH 7.4): 1951.30
Polar Surface Area: 93 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 43.5±7.0 dyne/cm
Molar Volume: 360.9±7.0 cm3

Click to predict properties on the Chemicalize site


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