ChemSpider 2D Image | 8-(4-Biphenylylcarbonyl)-3-[2-oxo-2-(1-piperidinyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one | C33H36N4O3

8-(4-Biphenylylcarbonyl)-3-[2-oxo-2-(1-piperidinyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one

  • Molecular FormulaC33H36N4O3
  • Average mass536.664 Da
  • Monoisotopic mass536.278748 Da
  • ChemSpider ID3766804

More details:

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

1,3,8-Triazaspiro[4.5]decan-4-one, 8-([1,1'-biphenyl]-4-ylcarbonyl)-3-[2-oxo-2-(1-piperidinyl)ethyl]-1-phenyl- [ACD/Index Name]
8-(4-Biphenylylcarbonyl)-3-[2-oxo-2-(1-piperidinyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-on [German] [ACD/IUPAC Name]
8-(4-Biphenylylcarbonyl)-3-[2-oxo-2-(1-piperidinyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one [ACD/IUPAC Name]
8-(4-Biphénylylcarbonyl)-3-[2-oxo-2-(1-pipéridinyl)éthyl]-1-phényl-1,3,8-triazaspiro[4.5]décan-4-one [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 799.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.2±3.0 kJ/mol
Flash Point: 357.9±25.2 °C
Index of Refraction: 1.678
Molar Refractivity: 155.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 706.13
ACD/KOC (pH 5.5): 3809.19
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 706.14
ACD/KOC (pH 7.4): 3809.22
Polar Surface Area: 64 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 67.0±5.0 dyne/cm
Molar Volume: 412.1±5.0 cm3

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