ChemSpider 2D Image | N-Benzyl-N-{1-[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]ethyl}-3,5-bis(trifluoromethyl)benzamide | C33H25F6N3O3

N-Benzyl-N-{1-[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]ethyl}-3,5-bis(trifluoromethyl)benzamide

  • Molecular FormulaC33H25F6N3O3
  • Average mass625.560 Da
  • Monoisotopic mass625.179993 Da
  • ChemSpider ID3206876

More details:

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

Benzamide, N-[1-[3,4-dihydro-3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-N-(phenylmethyl)-3,5-bis(trifluoromethyl)- [ACD/Index Name]
N-Benzyl-N-{1-[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-chinazolinyl]ethyl}-3,5-bis(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-Benzyl-N-{1-[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]ethyl}-3,5-bis(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-Benzyl-N-{1-[3-(4-méthoxyphényl)-4-oxo-3,4-dihydro-2-quinazolinyl]éthyl}-3,5-bis(trifluorométhyl)benzamide [French] [ACD/IUPAC 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: 698.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 376.0±34.3 °C
Index of Refraction: 1.572
Molar Refractivity: 155.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.00
ACD/LogD (pH 5.5): 6.36
ACD/BCF (pH 5.5): 40451.54
ACD/KOC (pH 5.5): 69055.63
ACD/LogD (pH 7.4): 6.36
ACD/BCF (pH 7.4): 40460.64
ACD/KOC (pH 7.4): 69071.17
Polar Surface Area: 62 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 39.6±7.0 dyne/cm
Molar Volume: 473.8±7.0 cm3

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