ChemSpider 2D Image | 1-[1,3-Dimethyl-2-oxo-6-(1-piperidinyl)-2,3-dihydro-1H-benzimidazol-5-yl]-3-(3-fluoro-4-methylphenyl)urea | C22H26FN5O2

1-[1,3-Dimethyl-2-oxo-6-(1-piperidinyl)-2,3-dihydro-1H-benzimidazol-5-yl]-3-(3-fluoro-4-methylphenyl)urea

  • Molecular FormulaC22H26FN5O2
  • Average mass411.473 Da
  • Monoisotopic mass411.207062 Da
  • ChemSpider ID21833913

More details:

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

1-[1,3-Dimethyl-2-oxo-6-(1-piperidinyl)-2,3-dihydro-1H-benzimidazol-5-yl]-3-(3-fluor-4-methylphenyl)harnstoff [German] [ACD/IUPAC Name]
1-[1,3-Dimethyl-2-oxo-6-(1-piperidinyl)-2,3-dihydro-1H-benzimidazol-5-yl]-3-(3-fluoro-4-methylphenyl)urea [ACD/IUPAC Name]
1-[1,3-Diméthyl-2-oxo-6-(1-pipéridinyl)-2,3-dihydro-1H-benzimidazol-5-yl]-3-(3-fluoro-4-méthylphényl)urée [French] [ACD/IUPAC Name]
Urea, N-[2,3-dihydro-1,3-dimethyl-2-oxo-6-(1-piperidinyl)-1H-benzimidazol-5-yl]-N'-(3-fluoro-4-methylphenyl)- [ACD/Index Name]
3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]-1-(3-fluoro-4-methylphenyl)urea
N-(1,3-dimethyl-2-oxo-6-piperidin-1-yl-2,3-dihydro-1H-benzimidazol-5-yl)-N'-(3-fluoro-4-methylphenyl)urea

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

Density: 1.3±0.1 g/cm3
Boiling Point: 503.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 258.0±30.1 °C
Index of Refraction: 1.658
Molar Refractivity: 114.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 3.44
ACD/KOC (pH 5.5): 21.85
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 122.47
ACD/KOC (pH 7.4): 776.87
Polar Surface Area: 68 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 310.3±3.0 cm3

Click to predict properties on the Chemicalize site


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