ChemSpider 2D Image | 3-Benzyl-8-methoxy-2-thioxo-2,3-dihydro-4(1H)-quinazolinone | C16H14N2O2S

3-Benzyl-8-methoxy-2-thioxo-2,3-dihydro-4(1H)-quinazolinone

  • Molecular FormulaC16H14N2O2S
  • Average mass298.360 Da
  • Monoisotopic mass298.077606 Da
  • ChemSpider ID30657739

More details:

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

3-Benzyl-8-methoxy-2-thioxo-2,3-dihydro-4(1H)-chinazolinon [German] [ACD/IUPAC Name]
3-Benzyl-8-methoxy-2-thioxo-2,3-dihydro-4(1H)-quinazolinone [ACD/IUPAC Name]
3-Benzyl-8-méthoxy-2-thioxo-2,3-dihydro-4(1H)-quinazolinone [French] [ACD/IUPAC Name]
4(1H)-Quinazolinone, 2,3-dihydro-8-methoxy-3-(phenylmethyl)-2-thioxo- [ACD/Index Name]
852239-42-0 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 472.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 239.2±31.5 °C
Index of Refraction: 1.699
Molar Refractivity: 84.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 97.83
ACD/KOC (pH 5.5): 925.53
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 97.82
ACD/KOC (pH 7.4): 925.41
Polar Surface Area: 74 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 69.5±5.0 dyne/cm
Molar Volume: 218.7±5.0 cm3

Click to predict properties on the Chemicalize site


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