ChemSpider 2D Image | 1-[3,5-Bis(trifluoromethyl)phenyl]-3-(2-{[6-(2-methyl-1H-imidazol-1-yl)-4-pyrimidinyl]amino}ethyl)urea | C19H17F6N7O

1-[3,5-Bis(trifluoromethyl)phenyl]-3-(2-{[6-(2-methyl-1H-imidazol-1-yl)-4-pyrimidinyl]amino}ethyl)urea

  • Molecular FormulaC19H17F6N7O
  • Average mass473.375 Da
  • Monoisotopic mass473.139862 Da
  • ChemSpider ID58390720

More details:

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

1-[3,5-Bis(trifluormethyl)phenyl]-3-(2-{[6-(2-methyl-1H-imidazol-1-yl)-4-pyrimidinyl]amino}ethyl)harnstoff [German] [ACD/IUPAC Name]
1-[3,5-Bis(trifluoromethyl)phenyl]-3-(2-{[6-(2-methyl-1H-imidazol-1-yl)-4-pyrimidinyl]amino}ethyl)urea [ACD/IUPAC Name]
1-[3,5-Bis(trifluorométhyl)phényl]-3-(2-{[6-(2-méthyl-1H-imidazol-1-yl)-4-pyrimidinyl]amino}éthyl)urée [French] [ACD/IUPAC Name]
Urea, N-[3,5-bis(trifluoromethyl)phenyl]-N'-[2-[[6-(2-methyl-1H-imidazol-1-yl)-4-pyrimidinyl]amino]ethyl]- [ACD/Index Name]
1-(3,5-bis(trifluoromethyl)phenyl)-3-(2-((6-(2-methyl-1H-imidazol-1-yl)pyrimidin-4-yl)amino)ethyl)urea

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.583
Molar Refractivity: 105.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 333.45
ACD/KOC (pH 5.5): 2098.71
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 409.22
ACD/KOC (pH 7.4): 2575.59
Polar Surface Area: 97 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 42.1±7.0 dyne/cm
Molar Volume: 316.2±7.0 cm3

Click to predict properties on the Chemicalize site


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