ChemSpider 2D Image | 1-(1-Pyrrolidinyl)-3-(5-{5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-1H-benzimidazol-1-yl)-1-propanone | C23H20F3N5O2

1-(1-Pyrrolidinyl)-3-(5-{5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-1H-benzimidazol-1-yl)-1-propanone

  • Molecular FormulaC23H20F3N5O2
  • Average mass455.432 Da
  • Monoisotopic mass455.156921 Da
  • ChemSpider ID29116198

More details:

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

1-(1-Pyrrolidinyl)-3-(5-{5-[4-(trifluormethyl)phenyl]-1,2,4-oxadiazol-3-yl}-1H-benzimidazol-1-yl)-1-propanon [German] [ACD/IUPAC Name]
1-(1-Pyrrolidinyl)-3-(5-{5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-1H-benzimidazol-1-yl)-1-propanone [ACD/IUPAC Name]
1-(1-Pyrrolidinyl)-3-(5-{5-[4-(trifluorométhyl)phényl]-1,2,4-oxadiazol-3-yl}-1H-benzimidazol-1-yl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-(1-pyrrolidinyl)-3-[5-[5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-1-yl]- [ACD/Index Name]
2-(4-Fluorophenyl)-N-(3-methylphenyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 647.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 345.1±34.3 °C
Index of Refraction: 1.657
Molar Refractivity: 115.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.60
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 502.94
ACD/KOC (pH 5.5): 2984.95
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 504.60
ACD/KOC (pH 7.4): 2994.81
Polar Surface Area: 77 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 313.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement