ChemSpider 2D Image | N-Benzyl-N-(2-{[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-methylbenzamide | C32H36N4O2

N-Benzyl-N-(2-{[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-methylbenzamide

  • Molecular FormulaC32H36N4O2
  • Average mass508.654 Da
  • Monoisotopic mass508.283813 Da
  • ChemSpider ID3213058

More details:

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

Benzamide, N-[2-[[3-(1,1-dimethylethyl)-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino]-2-oxoethyl]-2-methyl-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-N-(2-{[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-methylbenzamid [German] [ACD/IUPAC Name]
N-Benzyl-N-(2-{[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-methylbenzamide [ACD/IUPAC Name]
N-Benzyl-N-(2-{[1-(2,4-diméthylphényl)-3-(2-méthyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoéthyl)-2-méthylbenzamide [French] [ACD/IUPAC 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: 722.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.5±3.0 kJ/mol
Flash Point: 390.6±32.9 °C
Index of Refraction: 1.591
Molar Refractivity: 155.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.03
ACD/LogD (pH 5.5): 6.20
ACD/BCF (pH 5.5): 30350.10
ACD/KOC (pH 5.5): 56221.48
ACD/LogD (pH 7.4): 6.20
ACD/BCF (pH 7.4): 30352.86
ACD/KOC (pH 7.4): 56226.60
Polar Surface Area: 67 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 40.9±7.0 dyne/cm
Molar Volume: 458.7±7.0 cm3

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