ChemSpider 2D Image | N~2~-Benzyl-N~2~-(cyclohexylcarbamoyl)-N-[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]glycinamide | C31H41N5O2

N2-Benzyl-N2-(cyclohexylcarbamoyl)-N-[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]glycinamide

  • Molecular FormulaC31H41N5O2
  • Average mass515.690 Da
  • Monoisotopic mass515.326050 Da
  • ChemSpider ID3498007

More details:

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

Acetamide, 2-[[(cyclohexylamino)carbonyl](phenylmethyl)amino]-N-[3-(1,1-dimethylethyl)-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]- [ACD/Index Name]
N2-Benzyl-N2-(cyclohexylcarbamoyl)-N-[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]glycinamid [German] [ACD/IUPAC Name]
N2-Benzyl-N2-(cyclohexylcarbamoyl)-N-[1-(2,4-dimethylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]glycinamide [ACD/IUPAC Name]
N2-Benzyl-N2-(cyclohexylcarbamoyl)-N-[1-(2,4-diméthylphényl)-3-(2-méthyl-2-propanyl)-1H-pyrazol-5-yl]glycinamide [French] [ACD/IUPAC 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: 747.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.9±3.0 kJ/mol
Flash Point: 405.7±32.9 °C
Index of Refraction: 1.601
Molar Refractivity: 153.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.66
ACD/LogD (pH 5.5): 6.41
ACD/BCF (pH 5.5): 44145.70
ACD/KOC (pH 5.5): 73515.48
ACD/LogD (pH 7.4): 6.41
ACD/BCF (pH 7.4): 44150.40
ACD/KOC (pH 7.4): 73523.30
Polar Surface Area: 79 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 43.1±7.0 dyne/cm
Molar Volume: 448.2±7.0 cm3

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