ChemSpider 2D Image | (2R)-2-(4-Methoxyphenyl)-3-(4-phenoxyphenyl)-2,3-dihydro-4(1H)-quinazolinone | C27H22N2O3

(2R)-2-(4-Methoxyphenyl)-3-(4-phenoxyphenyl)-2,3-dihydro-4(1H)-quinazolinone

  • Molecular FormulaC27H22N2O3
  • Average mass422.475 Da
  • Monoisotopic mass422.163055 Da
  • ChemSpider ID30843743

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-(4-Methoxyphenyl)-3-(4-phenoxyphenyl)-2,3-dihydro-4(1H)-chinazolinon [German] [ACD/IUPAC Name]
(2R)-2-(4-Methoxyphenyl)-3-(4-phenoxyphenyl)-2,3-dihydro-4(1H)-quinazolinone [ACD/IUPAC Name]
(2R)-2-(4-Méthoxyphényl)-3-(4-phénoxyphényl)-2,3-dihydro-4(1H)-quinazolinone [French] [ACD/IUPAC Name]
4(1H)-Quinazolinone, 2,3-dihydro-2-(4-methoxyphenyl)-3-(4-phenoxyphenyl)-, (2R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 634.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 337.2±31.5 °C
Index of Refraction: 1.636
Molar Refractivity: 122.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 5.23
ACD/BCF (pH 5.5): 5584.92
ACD/KOC (pH 5.5): 16738.09
ACD/LogD (pH 7.4): 5.23
ACD/BCF (pH 7.4): 5584.99
ACD/KOC (pH 7.4): 16738.29
Polar Surface Area: 51 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 342.8±3.0 cm3

Click to predict properties on the Chemicalize site


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