ChemSpider 2D Image | 3-Bromo-N-[3-fluoro-4-(1H-imidazol-1-yl)phenyl]-1H-indole-2-carboxamide | C18H12BrFN4O

3-Bromo-N-[3-fluoro-4-(1H-imidazol-1-yl)phenyl]-1H-indole-2-carboxamide

  • Molecular FormulaC18H12BrFN4O
  • Average mass399.216 Da
  • Monoisotopic mass398.017853 Da
  • ChemSpider ID70811135

More details:

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

1H-Indole-2-carboxamide, 3-bromo-N-[3-fluoro-4-(1H-imidazol-1-yl)phenyl]- [ACD/Index Name]
3-Brom-N-[3-fluor-4-(1H-imidazol-1-yl)phenyl]-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
3-Bromo-N-[3-fluoro-4-(1H-imidazol-1-yl)phenyl]-1H-indole-2-carboxamide [ACD/IUPAC Name]
3-Bromo-N-[3-fluoro-4-(1H-imidazol-1-yl)phényl]-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 525.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.8±30.1 °C
Index of Refraction: 1.716
Molar Refractivity: 96.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 129.81
ACD/KOC (pH 5.5): 990.88
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 206.61
ACD/KOC (pH 7.4): 1577.08
Polar Surface Area: 63 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 56.1±7.0 dyne/cm
Molar Volume: 245.9±7.0 cm3

Click to predict properties on the Chemicalize site


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