ChemSpider 2D Image | 3-(3-Fluoro-4-methoxybenzyl)-2-(4-phenyl-1-piperazinyl)-4(3H)-quinazolinone | C26H25FN4O2

3-(3-Fluoro-4-methoxybenzyl)-2-(4-phenyl-1-piperazinyl)-4(3H)-quinazolinone

  • Molecular FormulaC26H25FN4O2
  • Average mass444.501 Da
  • Monoisotopic mass444.196167 Da
  • ChemSpider ID30755661

More details:

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

3-(3-Fluor-4-methoxybenzyl)-2-(4-phenyl-1-piperazinyl)-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
3-(3-Fluoro-4-methoxybenzyl)-2-(4-phenyl-1-piperazinyl)-4(3H)-quinazolinone [ACD/IUPAC Name]
3-(3-Fluoro-4-méthoxybenzyl)-2-(4-phényl-1-pipérazinyl)-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
4(3H)-Quinazolinone, 3-[(3-fluoro-4-methoxyphenyl)methyl]-2-(4-phenyl-1-piperazinyl)- [ACD/Index Name]
1428366-93-1 [RN]
3-(3-fluoro-4-methoxybenzyl)-2-(4-phenylpiperazin-1-yl)quinazolin-4(3H)-one
3-[(3-fluoro-4-methoxyphenyl)methyl]-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazolin-4-one
3-[(3-FLUORO-4-METHOXYPHENYL)METHYL]-2-(4-PHENYLPIPERAZIN-1-YL)QUINAZOLIN-4-ONE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 623.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.3±3.0 kJ/mol
Flash Point: 330.9±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 126.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 134.37
ACD/KOC (pH 5.5): 917.89
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 302.73
ACD/KOC (pH 7.4): 2067.99
Polar Surface Area: 48 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 48.0±7.0 dyne/cm
Molar Volume: 351.1±7.0 cm3

Click to predict properties on the Chemicalize site


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