ChemSpider 2D Image | 1-Butyl-1-{1-[3-(2-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]propyl}-3-[2-(trifluoromethyl)phenyl]urea | C30H31F3N4O3

1-Butyl-1-{1-[3-(2-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]propyl}-3-[2-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC30H31F3N4O3
  • Average mass552.587 Da
  • Monoisotopic mass552.234802 Da
  • ChemSpider ID22590179

More details:

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

1-Butyl-1-{1-[3-(2-methoxyphenyl)-4-oxo-3,4-dihydro-2-chinazolinyl]propyl}-3-[2-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-Butyl-1-{1-[3-(2-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]propyl}-3-[2-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-Butyl-1-{1-[3-(2-méthoxyphényl)-4-oxo-3,4-dihydro-2-quinazolinyl]propyl}-3-[2-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
Urea, N-butyl-N-[1-[3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]propyl]-N'-[2-(trifluoromethyl)phenyl]- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.578
Molar Refractivity: 147.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.52
ACD/LogD (pH 5.5): 5.57
ACD/BCF (pH 5.5): 10126.35
ACD/KOC (pH 5.5): 25626.06
ACD/LogD (pH 7.4): 5.57
ACD/BCF (pH 7.4): 10127.12
ACD/KOC (pH 7.4): 25628.00
Polar Surface Area: 74 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 41.1±7.0 dyne/cm
Molar Volume: 444.2±7.0 cm3

Click to predict properties on the Chemicalize site


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