ChemSpider 2D Image | 2-{4-[2-(1-Pyrrolidinyl)ethyl]-1-piperazinyl}-6-[3-(trifluoromethyl)phenyl]pyrazine | C21H26F3N5

2-{4-[2-(1-Pyrrolidinyl)ethyl]-1-piperazinyl}-6-[3-(trifluoromethyl)phenyl]pyrazine

  • Molecular FormulaC21H26F3N5
  • Average mass405.460 Da
  • Monoisotopic mass405.214020 Da
  • ChemSpider ID26641974

More details:

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

2-{4-[2-(1-Pyrrolidinyl)ethyl]-1-piperazinyl}-6-[3-(trifluormethyl)phenyl]pyrazin [German] [ACD/IUPAC Name]
2-{4-[2-(1-Pyrrolidinyl)ethyl]-1-piperazinyl}-6-[3-(trifluoromethyl)phenyl]pyrazine [ACD/IUPAC Name]
2-{4-[2-(1-Pyrrolidinyl)éthyl]-1-pipérazinyl}-6-[3-(trifluorométhyl)phényl]pyrazine [French] [ACD/IUPAC Name]
Pyrazine, 2-[4-[2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]-6-[3-(trifluoromethyl)phenyl]- [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: 508.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 261.3±30.1 °C
Index of Refraction: 1.547
Molar Refractivity: 105.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.89
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 36.78
ACD/KOC (pH 7.4): 214.69
Polar Surface Area: 36 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 331.4±3.0 cm3

Click to predict properties on the Chemicalize site


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