ChemSpider 2D Image | N-(2-Phenylethyl)-3-{[1-(tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]oxy}benzamide | C25H32N2O2S

N-(2-Phenylethyl)-3-{[1-(tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]oxy}benzamide

  • Molecular FormulaC25H32N2O2S
  • Average mass424.599 Da
  • Monoisotopic mass424.218445 Da
  • ChemSpider ID22171428

More details:

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

Benzamide, N-(2-phenylethyl)-3-[[1-(tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]oxy]- [ACD/Index Name]
N-(2-Phenylethyl)-3-{[1-(tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]oxy}benzamid [German] [ACD/IUPAC Name]
N-(2-Phenylethyl)-3-{[1-(tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]oxy}benzamide [ACD/IUPAC Name]
N-(2-Phényléthyl)-3-{[1-(tétrahydro-2H-thiopyrane-4-yl)-4-pipéridinyl]oxy}benzamide [French] [ACD/IUPAC Name]
N-(2-PHENYLETHYL)-3-{[1-(THIAN-4-YL)PIPERIDIN-4-YL]OXY}BENZAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 612.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 323.9±31.5 °C
Index of Refraction: 1.602
Molar Refractivity: 124.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 2.32
ACD/BCF (pH 5.5): 9.02
ACD/KOC (pH 5.5): 34.46
ACD/LogD (pH 7.4): 4.03
ACD/BCF (pH 7.4): 460.55
ACD/KOC (pH 7.4): 1758.60
Polar Surface Area: 67 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 364.1±3.0 cm3

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