ChemSpider 2D Image | N-Methyl-N-[2-(4-methylphenoxy)ethyl]-6-(tetrahydro-2H-thiopyran-4-yl)-6-azaspiro[2.5]octane-1-carboxamide | C23H34N2O2S

N-Methyl-N-[2-(4-methylphenoxy)ethyl]-6-(tetrahydro-2H-thiopyran-4-yl)-6-azaspiro[2.5]octane-1-carboxamide

  • Molecular FormulaC23H34N2O2S
  • Average mass402.593 Da
  • Monoisotopic mass402.234100 Da
  • ChemSpider ID22146052

More details:

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

6-Azaspiro[2.5]octane-1-carboxamide, N-methyl-N-[2-(4-methylphenoxy)ethyl]-6-(tetrahydro-2H-thiopyran-4-yl)- [ACD/Index Name]
N-Methyl-N-[2-(4-methylphenoxy)ethyl]-6-(tetrahydro-2H-thiopyran-4-yl)-6-azaspiro[2.5]octan-1-carboxamid [German] [ACD/IUPAC Name]
N-Methyl-N-[2-(4-methylphenoxy)ethyl]-6-(tetrahydro-2H-thiopyran-4-yl)-6-azaspiro[2.5]octane-1-carboxamide [ACD/IUPAC Name]
N-Méthyl-N-[2-(4-méthylphénoxy)éthyl]-6-(tétrahydro-2H-thiopyrane-4-yl)-6-azaspiro[2.5]octane-1-carboxamide [French] [ACD/IUPAC Name]
N-METHYL-N-[2-(4-METHYLPHENOXY)ETHYL]-6-(THIAN-4-YL)-6-AZASPIRO[2.5]OCTANE-1-CARBOXAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 573.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 300.7±30.1 °C
Index of Refraction: 1.599
Molar Refractivity: 116.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.77
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 3.23
ACD/KOC (pH 7.4): 23.08
Polar Surface Area: 58 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 342.3±5.0 cm3

Click to predict properties on the Chemicalize site


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