ChemSpider 2D Image | 4-Butyl-N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-propylbenzamide | C33H38N4O3

4-Butyl-N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-propylbenzamide

  • Molecular FormulaC33H38N4O3
  • Average mass538.680 Da
  • Monoisotopic mass538.294373 Da
  • ChemSpider ID2700602

More details:

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

4-Butyl-N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-propylbenzamid [German] [ACD/IUPAC Name]
4-Butyl-N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-propylbenzamide [ACD/IUPAC Name]
4-Butyl-N-(2-{[1-(4-méthoxyphényl)-3-méthyl-4-phényl-1H-pyrazol-5-yl]amino}-2-oxoéthyl)-N-propylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 4-butyl-N-[2-[[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino]-2-oxoethyl]-N-propyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 706.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.3±3.0 kJ/mol
Flash Point: 380.9±32.9 °C
Index of Refraction: 1.589
Molar Refractivity: 160.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.64
ACD/LogD (pH 5.5): 5.42
ACD/BCF (pH 5.5): 7726.80
ACD/KOC (pH 5.5): 21115.98
ACD/LogD (pH 7.4): 5.42
ACD/BCF (pH 7.4): 7727.34
ACD/KOC (pH 7.4): 21117.46
Polar Surface Area: 76 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 42.3±7.0 dyne/cm
Molar Volume: 477.5±7.0 cm3

Click to predict properties on the Chemicalize site


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