Found 45 results

Search term: MF = 'C_{29}H_{28}ClF_{3}N_{4}O_{2}'
ChemSpider 2D Image | 1-{1-[3-(3-Chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]propyl}-1-isobutyl-3-[2-(trifluoromethyl)phenyl]urea | C29H28ClF3N4O2

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

  • Molecular FormulaC29H28ClF3N4O2
  • Average mass557.006 Da
  • Monoisotopic mass556.185303 Da
  • ChemSpider ID3537085

More details:

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

1-{1-[3-(3-Chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]propyl}-1-isobutyl-3-[2-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-{1-[3-(3-Chlorophényl)-4-oxo-3,4-dihydro-2-quinazolinyl]propyl}-1-isobutyl-3-[2-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
1-{1-[3-(3-Chlorphenyl)-4-oxo-3,4-dihydro-2-chinazolinyl]propyl}-1-isobutyl-3-[2-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
Urea, N-[1-[3-(3-chlorophenyl)-3,4-dihydro-4-oxo-2-quinazolinyl]propyl]-N-(2-methylpropyl)-N'-[2-(trifluoromethyl)phenyl]- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.592
Molar Refractivity: 145.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.02
ACD/LogD (pH 5.5): 6.18
ACD/BCF (pH 5.5): 29053.67
ACD/KOC (pH 5.5): 54492.50
ACD/LogD (pH 7.4): 6.18
ACD/BCF (pH 7.4): 29055.04
ACD/KOC (pH 7.4): 54495.07
Polar Surface Area: 65 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 41.8±7.0 dyne/cm
Molar Volume: 431.0±7.0 cm3

Click to predict properties on the Chemicalize site


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