ChemSpider 2D Image | 2-(5,7-Diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)-1-(4-phenyl-1-piperazinyl)ethanone | C28H27N7O

2-(5,7-Diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)-1-(4-phenyl-1-piperazinyl)ethanone

  • Molecular FormulaC28H27N7O
  • Average mass477.560 Da
  • Monoisotopic mass477.227722 Da
  • ChemSpider ID29020353

More details:

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

2-(5,7-Diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)-1-(4-phenyl-1-piperazinyl)ethanon [German] [ACD/IUPAC Name]
2-(5,7-Diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)-1-(4-phenyl-1-piperazinyl)ethanone [ACD/IUPAC Name]
2-(5,7-Diphényltétrazolo[1,5-a]pyrimidin-4(7H)-yl)-1-(4-phényl-1-pipérazinyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-(5,7-diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)-1-(4-phenyl-1-piperazinyl)- [ACD/Index 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: 731.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.7±3.0 kJ/mol
Flash Point: 395.9±35.7 °C
Index of Refraction: 1.704
Molar Refractivity: 142.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 349.21
ACD/KOC (pH 5.5): 2298.79
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 350.45
ACD/KOC (pH 7.4): 2306.97
Polar Surface Area: 70 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 57.4±7.0 dyne/cm
Molar Volume: 366.3±7.0 cm3

Click to predict properties on the Chemicalize site


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