ChemSpider 2D Image | N-[1-(1,4'-Bipiperidin-1'-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]-2-cyclohexylacetamide | C23H41N3O2S

N-[1-(1,4'-Bipiperidin-1'-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]-2-cyclohexylacetamide

  • Molecular FormulaC23H41N3O2S
  • Average mass423.655 Da
  • Monoisotopic mass423.291962 Da
  • ChemSpider ID117847701

More details:

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

Cyclohexaneacetamide, N-[1-([1,4'-bipiperidin]-1'-ylcarbonyl)-3-(methylthio)propyl]- [ACD/Index Name]
N-[1-(1,4'-Bipiperidin-1'-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]-2-cyclohexylacetamid [German] [ACD/IUPAC Name]
N-[1-(1,4'-Bipiperidin-1'-yl)-4-(methylsulfanyl)-1-oxo-2-butanyl]-2-cyclohexylacetamide [ACD/IUPAC Name]
N-[1-(1,4'-Bipipéridin-1'-yl)-4-(méthylsulfanyl)-1-oxo-2-butanyl]-2-cyclohexylacétamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 635.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 338.2±31.5 °C
Index of Refraction: 1.540
Molar Refractivity: 120.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.40
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.84
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 24.12
ACD/KOC (pH 7.4): 126.61
Polar Surface Area: 78 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 385.2±3.0 cm3

Click to predict properties on the Chemicalize site


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