ChemSpider 2D Image | 4-{5-(4-Fluorophenyl)-3-[1-(2-phenylethyl)-1,2,3,6-tetrahydro-4-pyridinyl]-2H-pyrrol-4-yl}pyridine | C28H26FN3

4-{5-(4-Fluorophenyl)-3-[1-(2-phenylethyl)-1,2,3,6-tetrahydro-4-pyridinyl]-2H-pyrrol-4-yl}pyridine

  • Molecular FormulaC28H26FN3
  • Average mass423.525 Da
  • Monoisotopic mass423.211090 Da
  • ChemSpider ID111291216

More details:

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

4-{5-(4-Fluorophenyl)-3-[1-(2-phenylethyl)-1,2,3,6-tetrahydro-4-pyridinyl]-2H-pyrrol-4-yl}pyridine [ACD/IUPAC Name]
4-{5-(4-Fluorophényl)-3-[1-(2-phényléthyl)-1,2,3,6-tétrahydro-4-pyridinyl]-2H-pyrrol-4-yl}pyridine [French] [ACD/IUPAC Name]
4-{5-(4-Fluorphenyl)-3-[1-(2-phenylethyl)-1,2,3,6-tetrahydro-4-pyridinyl]-2H-pyrrol-4-yl}pyridin [German] [ACD/IUPAC Name]
Pyridine, 4-[5-(4-fluorophenyl)-4-(4-pyridinyl)-2H-pyrrol-3-yl]-1,2,3,6-tetrahydro-1-(2-phenylethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 579.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 304.4±30.1 °C
Index of Refraction: 1.627
Molar Refractivity: 128.8±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 2.32
ACD/BCF (pH 5.5): 5.85
ACD/KOC (pH 5.5): 15.19
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 358.93
ACD/KOC (pH 7.4): 931.81
Polar Surface Area: 28 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 43.8±7.0 dyne/cm
Molar Volume: 363.5±7.0 cm3

Click to predict properties on the Chemicalize site


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