ChemSpider 2D Image | 8-[Bis(2-chlorophenyl)methyl]-N-(2-hydroxypropyl)-3-phenyl-8-azabicyclo[3.2.1]octane-3-carboxamide | C30H32Cl2N2O2

8-[Bis(2-chlorophenyl)methyl]-N-(2-hydroxypropyl)-3-phenyl-8-azabicyclo[3.2.1]octane-3-carboxamide

  • Molecular FormulaC30H32Cl2N2O2
  • Average mass523.493 Da
  • Monoisotopic mass522.184082 Da
  • ChemSpider ID24692913

More details:

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

8-[Bis(2-chlorophenyl)methyl]-N-(2-hydroxypropyl)-3-phenyl-8-azabicyclo[3.2.1]octane-3-carboxamide [ACD/IUPAC Name]
8-[Bis(2-chlorophényl)méthyl]-N-(2-hydroxypropyl)-3-phényl-8-azabicyclo[3.2.1]octane-3-carboxamide [French] [ACD/IUPAC Name]
8-[Bis(2-chlorphenyl)methyl]-N-(2-hydroxypropyl)-3-phenyl-8-azabicyclo[3.2.1]octan-3-carboxamid [German] [ACD/IUPAC Name]
8-Azabicyclo[3.2.1]octane-3-carboxamide, 8-[bis(2-chlorophenyl)methyl]-N-(2-hydroxypropyl)-3-phenyl- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL466694/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 673.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.0±3.0 kJ/mol
Flash Point: 361.3±31.5 °C
Index of Refraction: 1.619
Molar Refractivity: 145.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.09
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 109.10
ACD/KOC (pH 5.5): 281.94
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 4376.14
ACD/KOC (pH 7.4): 11308.46
Polar Surface Area: 53 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 52.3±3.0 dyne/cm
Molar Volume: 413.6±3.0 cm3

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