ChemSpider 2D Image | (5-Bromo-2-fluorophenyl)[3-(1-isopropyl-1H-benzimidazol-2-yl)-1-piperidinyl]methanone | C22H23BrFN3O

(5-Bromo-2-fluorophenyl)[3-(1-isopropyl-1H-benzimidazol-2-yl)-1-piperidinyl]methanone

  • Molecular FormulaC22H23BrFN3O
  • Average mass444.340 Da
  • Monoisotopic mass443.100861 Da
  • ChemSpider ID31986541

More details:

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

(5-Brom-2-fluorphenyl)[3-(1-isopropyl-1H-benzimidazol-2-yl)-1-piperidinyl]methanon [German] [ACD/IUPAC Name]
(5-Bromo-2-fluorophenyl)[3-(1-isopropyl-1H-benzimidazol-2-yl)-1-piperidinyl]methanone [ACD/IUPAC Name]
(5-Bromo-2-fluorophényl)[3-(1-isopropyl-1H-benzimidazol-2-yl)-1-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (5-bromo-2-fluorophenyl)[3-[1-(1-methylethyl)-1H-benzimidazol-2-yl]-1-piperidinyl]- [ACD/Index 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: 598.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.1±3.0 kJ/mol
Flash Point: 315.8±30.1 °C
Index of Refraction: 1.647
Molar Refractivity: 112.6±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 343.19
ACD/KOC (pH 5.5): 1631.02
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 1072.69
ACD/KOC (pH 7.4): 5097.96
Polar Surface Area: 38 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 46.0±7.0 dyne/cm
Molar Volume: 309.8±7.0 cm3

Click to predict properties on the Chemicalize site


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