ChemSpider 2D Image | 2-[4-(4-Chloro-2-fluorobenzoyl)-1-piperazinyl]-N-(tetrahydro-2-furanylmethyl)nicotinamide | C22H24ClFN4O3

2-[4-(4-Chloro-2-fluorobenzoyl)-1-piperazinyl]-N-(tetrahydro-2-furanylmethyl)nicotinamide

  • Molecular FormulaC22H24ClFN4O3
  • Average mass446.902 Da
  • Monoisotopic mass446.152100 Da
  • ChemSpider ID22745324

More details:

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

2-[4-(4-Chlor-2-fluorbenzoyl)-1-piperazinyl]-N-(tetrahydro-2-furanylmethyl)nicotinamid [German] [ACD/IUPAC Name]
2-[4-(4-Chloro-2-fluorobenzoyl)-1-piperazinyl]-N-(tetrahydro-2-furanylmethyl)nicotinamide [ACD/IUPAC Name]
2-[4-(4-Chloro-2-fluorobenzoyl)-1-pipérazinyl]-N-(tétrahydro-2-furanylméthyl)nicotinamide [French] [ACD/IUPAC Name]
3-Pyridinecarboxamide, 2-[4-(4-chloro-2-fluorobenzoyl)-1-piperazinyl]-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 679.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 365.0±31.5 °C
Index of Refraction: 1.598
Molar Refractivity: 114.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.05
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.42
ACD/LogD (pH 7.4): 1.60
ACD/BCF (pH 7.4): 9.36
ACD/KOC (pH 7.4): 164.72
Polar Surface Area: 75 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 53.6±3.0 dyne/cm
Molar Volume: 335.3±3.0 cm3

Click to predict properties on the Chemicalize site


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