Found 583 results

Search term: MF = 'C_{30}H_{32}FN_{5}O_{2}'
ChemSpider 2D Image | 1-Benzyl-1-{[3-(4-fluorophenyl)-5-(4-methyl-1-piperazinyl)-1,2-oxazol-4-yl]methyl}-3-(4-methylphenyl)urea | C30H32FN5O2

1-Benzyl-1-{[3-(4-fluorophenyl)-5-(4-methyl-1-piperazinyl)-1,2-oxazol-4-yl]methyl}-3-(4-methylphenyl)urea

  • Molecular FormulaC30H32FN5O2
  • Average mass513.606 Da
  • Monoisotopic mass513.254028 Da
  • ChemSpider ID22695107

More details:

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

1-Benzyl-1-{[3-(4-fluorophenyl)-5-(4-methyl-1-piperazinyl)-1,2-oxazol-4-yl]methyl}-3-(4-methylphenyl)urea [ACD/IUPAC Name]
1-Benzyl-1-{[3-(4-fluorophényl)-5-(4-méthyl-1-pipérazinyl)-1,2-oxazol-4-yl]méthyl}-3-(4-méthylphényl)urée [French] [ACD/IUPAC Name]
1-Benzyl-1-{[3-(4-fluorphenyl)-5-(4-methyl-1-piperazinyl)-1,2-oxazol-4-yl]methyl}-3-(4-methylphenyl)harnstoff [German] [ACD/IUPAC Name]
Urea, N-[[3-(4-fluorophenyl)-5-(4-methyl-1-piperazinyl)-4-isoxazolyl]methyl]-N'-(4-methylphenyl)-N-(phenylmethyl)- [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: 753.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.7±3.0 kJ/mol
Flash Point: 409.2±32.9 °C
Index of Refraction: 1.626
Molar Refractivity: 146.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.87
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 38.28
ACD/KOC (pH 5.5): 178.34
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 853.65
ACD/KOC (pH 7.4): 3977.15
Polar Surface Area: 65 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 412.8±3.0 cm3

Click to predict properties on the Chemicalize site


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