ChemSpider 2D Image | 1-[bis(4-fluorophenyl)methyl]-4-(1H-1,2,4-triazol-1-ylcarbonyl)piperazine | C20H19F2N5O

1-[bis(4-fluorophenyl)methyl]-4-(1H-1,2,4-triazol-1-ylcarbonyl)piperazine

  • Molecular FormulaC20H19F2N5O
  • Average mass383.395 Da
  • Monoisotopic mass383.155762 Da
  • ChemSpider ID25059182

More details:

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

{4-[Bis(4-fluorophenyl)methyl]-1-piperazinyl}(1H-1,2,4-triazol-1-yl)methanone [ACD/IUPAC Name]
{4-[Bis(4-fluorophényl)méthyl]-1-pipérazinyl}(1H-1,2,4-triazol-1-yl)méthanone [French] [ACD/IUPAC Name]
{4-[Bis(4-fluorphenyl)methyl]-1-piperazinyl}(1H-1,2,4-triazol-1-yl)methanon [German] [ACD/IUPAC Name]
1-[bis(4-fluorophenyl)methyl]-4-(1H-1,2,4-triazol-1-ylcarbonyl)piperazine
Methanone, [4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-1H-1,2,4-triazol-1-yl- [ACD/Index Name]
[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(1,2,4-triazol-1-yl)methanone
1221418-42-3 [RN]
F4P
SAR629

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

Density: 1.3±0.1 g/cm3
Boiling Point: 505.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 259.5±32.9 °C
Index of Refraction: 1.643
Molar Refractivity: 103.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 4.84
ACD/KOC (pH 5.5): 92.80
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.10
ACD/KOC (pH 7.4): 155.24
Polar Surface Area: 54 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 49.2±7.0 dyne/cm
Molar Volume: 285.2±7.0 cm3

Click to predict properties on the Chemicalize site


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