ChemSpider 2D Image | 4-{4-[(5-Methyl-1H-imidazol-4-yl)methyl]-1-piperazinyl}-2-(trifluoromethyl)quinoline | C19H20F3N5

4-{4-[(5-Methyl-1H-imidazol-4-yl)methyl]-1-piperazinyl}-2-(trifluoromethyl)quinoline

  • Molecular FormulaC19H20F3N5
  • Average mass375.391 Da
  • Monoisotopic mass375.167084 Da
  • ChemSpider ID35076063

More details:






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

4-{4-[(5-Methyl-1H-imidazol-4-yl)methyl]-1-piperazinyl}-2-(trifluormethyl)chinolin [German] [ACD/IUPAC Name]
4-{4-[(5-Méthyl-1H-imidazol-4-yl)méthyl]-1-pipérazinyl}-2-(trifluorométhyl)quinoléine [French] [ACD/IUPAC Name]
4-{4-[(5-Methyl-1H-imidazol-4-yl)methyl]-1-piperazinyl}-2-(trifluoromethyl)quinoline [ACD/IUPAC Name]
Quinoline, 4-[4-[(5-methyl-1H-imidazol-4-yl)methyl]-1-piperazinyl]-2-(trifluoromethyl)- [ACD/Index Name]
4-{4-[(5-methyl-1H-imidazol-4-yl)methyl]piperazin-1-yl}-2-(trifluoromethyl)quinoline

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 558.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.1±3.0 kJ/mol
Flash Point: 291.6±30.1 °C
Index of Refraction: 1.614
Molar Refractivity: 97.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.97
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.72
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 31.11
ACD/KOC (pH 7.4): 293.55
Polar Surface Area: 48 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 279.7±3.0 cm3

Click to predict properties on the Chemicalize site






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