ChemSpider 2D Image | 3-{1-[2-(Difluoromethoxy)benzyl]-3-piperidinyl}-N-(2-fluorobenzyl)propanamide | C23H27F3N2O2

3-{1-[2-(Difluoromethoxy)benzyl]-3-piperidinyl}-N-(2-fluorobenzyl)propanamide

  • Molecular FormulaC23H27F3N2O2
  • Average mass420.468 Da
  • Monoisotopic mass420.202454 Da
  • ChemSpider ID22165540

More details:

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

3-{1-[2-(Difluormethoxy)benzyl]-3-piperidinyl}-N-(2-fluorbenzyl)propanamid [German] [ACD/IUPAC Name]
3-{1-[2-(Difluoromethoxy)benzyl]-3-piperidinyl}-N-(2-fluorobenzyl)propanamide [ACD/IUPAC Name]
3-{1-[2-(Difluorométhoxy)benzyl]-3-pipéridinyl}-N-(2-fluorobenzyl)propanamide [French] [ACD/IUPAC Name]
3-Piperidinepropanamide, 1-[[2-(difluoromethoxy)phenyl]methyl]-N-[(2-fluorophenyl)methyl]- [ACD/Index Name]
3-(1-{[2-(DIFLUOROMETHOXY)PHENYL]METHYL}PIPERIDIN-3-YL)-N-[(2-FLUOROPHENYL)METHYL]PROPANAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 544.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.4±30.1 °C
Index of Refraction: 1.533
Molar Refractivity: 109.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.06
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 13.05
ACD/KOC (pH 7.4): 82.89
Polar Surface Area: 42 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 352.5±3.0 cm3

Click to predict properties on the Chemicalize site


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