ChemSpider 2D Image | N-{1-[1-(2,3-Difluorobenzyl)-4-piperidinyl]-2-phenylethyl}-N-ethyltetrahydro-2H-pyran-4-carboxamide | C28H36F2N2O2

N-{1-[1-(2,3-Difluorobenzyl)-4-piperidinyl]-2-phenylethyl}-N-ethyltetrahydro-2H-pyran-4-carboxamide

  • Molecular FormulaC28H36F2N2O2
  • Average mass470.594 Da
  • Monoisotopic mass470.274475 Da
  • ChemSpider ID22165624

More details:

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

2H-Pyran-4-carboxamide, N-[1-[1-[(2,3-difluorophenyl)methyl]-4-piperidinyl]-2-phenylethyl]-N-ethyltetrahydro- [ACD/Index Name]
N-{1-[1-(2,3-Difluorbenzyl)-4-piperidinyl]-2-phenylethyl}-N-ethyltetrahydro-2H-pyran-4-carboxamid [German] [ACD/IUPAC Name]
N-{1-[1-(2,3-Difluorobenzyl)-4-piperidinyl]-2-phenylethyl}-N-ethyltetrahydro-2H-pyran-4-carboxamide [ACD/IUPAC Name]
N-{1-[1-(2,3-Difluorobenzyl)-4-pipéridinyl]-2-phényléthyl}-N-éthyltétrahydro-2H-pyrane-4-carboxamide [French] [ACD/IUPAC 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: 585.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 307.8±30.1 °C
Index of Refraction: 1.554
Molar Refractivity: 129.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 2.85
ACD/BCF (pH 5.5): 28.38
ACD/KOC (pH 5.5): 101.70
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1228.19
ACD/KOC (pH 7.4): 4401.25
Polar Surface Area: 33 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 404.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement