ChemSpider 2D Image | 3-(4-Biphenylyl)-8-[(3-methyl-2-pyridinyl)methyl]-1-(6-oxo-1,6-dihydro-4-pyrimidinyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione | C30H28N6O3

3-(4-Biphenylyl)-8-[(3-methyl-2-pyridinyl)methyl]-1-(6-oxo-1,6-dihydro-4-pyrimidinyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione

  • Molecular FormulaC30H28N6O3
  • Average mass520.582 Da
  • Monoisotopic mass520.222290 Da
  • ChemSpider ID28522824

More details:

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

1,3,8-Triazaspiro[4.5]decane-2,4-dione, 3-[1,1'-biphenyl]-4-yl-1-(6-hydroxy-4-pyrimidinyl)-8-[(3-methyl-2-pyridinyl)methyl]- [ACD/Index Name]
3-(4-Biphenylyl)-8-[(3-methyl-2-pyridinyl)methyl]-1-(6-oxo-1,6-dihydro-4-pyrimidinyl)-1,3,8-triazaspiro[4.5]decan-2,4-dion [German] [ACD/IUPAC Name]
3-(4-Biphenylyl)-8-[(3-methyl-2-pyridinyl)methyl]-1-(6-oxo-1,6-dihydro-4-pyrimidinyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione [ACD/IUPAC Name]
3-(4-Biphénylyl)-8-[(3-méthyl-2-pyridinyl)méthyl]-1-(6-oxo-1,6-dihydro-4-pyrimidinyl)-1,3,8-triazaspiro[4.5]décane-2,4-dione [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 733.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.9±3.0 kJ/mol
Flash Point: 397.6±35.7 °C
Index of Refraction: 1.728
Molar Refractivity: 145.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 1.03
ACD/KOC (pH 5.5): 9.81
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 12.63
ACD/KOC (pH 7.4): 119.85
Polar Surface Area: 103 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 86.0±5.0 dyne/cm
Molar Volume: 364.7±5.0 cm3

Click to predict properties on the Chemicalize site


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