ChemSpider 2D Image | [4-[7-hydroxy-3-(p-tolylmethyl)triazolo[5,4-d]pyrimidin-5-yl]-1-piperidyl]-(4-phenylphenyl)methanone | C30H28N6O2

[4-[7-hydroxy-3-(p-tolylmethyl)triazolo[5,4-d]pyrimidin-5-yl]-1-piperidyl]-(4-phenylphenyl)methanone

  • Molecular FormulaC30H28N6O2
  • Average mass504.582 Da
  • Monoisotopic mass504.227386 Da
  • ChemSpider ID17901520

More details:

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.707
Molar Refractivity: 147.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 2.23
ACD/KOC (pH 5.5): 13.34
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 1.95
ACD/KOC (pH 7.4): 11.65
Polar Surface Area: 97 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 56.3±7.0 dyne/cm
Molar Volume: 377.9±7.0 cm3

Click to predict properties on the Chemicalize site


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