ChemSpider 2D Image | N-(3-Methoxypropyl)-N-(2-{[1-(4-methylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-pentylbenzamide | C32H44N4O3

N-(3-Methoxypropyl)-N-(2-{[1-(4-methylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-pentylbenzamide

  • Molecular FormulaC32H44N4O3
  • Average mass532.717 Da
  • Monoisotopic mass532.341370 Da
  • ChemSpider ID3475676

More details:

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

Benzamide, N-[2-[[3-(1,1-dimethylethyl)-1-(4-methylphenyl)-1H-pyrazol-5-yl]amino]-2-oxoethyl]-N-(3-methoxypropyl)-4-pentyl- [ACD/Index Name]
N-(3-Methoxypropyl)-N-(2-{[1-(4-methylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-pentylbenzamid [German] [ACD/IUPAC Name]
N-(3-Methoxypropyl)-N-(2-{[1-(4-methylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-pentylbenzamide [ACD/IUPAC Name]
N-(3-Méthoxypropyl)-N-(2-{[1-(4-méthylphényl)-3-(2-méthyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoéthyl)-4-pentylbenzamide [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: 705.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.2±3.0 kJ/mol
Flash Point: 380.4±32.9 °C
Index of Refraction: 1.557
Molar Refractivity: 158.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 6.97
ACD/LogD (pH 5.5): 6.86
ACD/BCF (pH 5.5): 96282.78
ACD/KOC (pH 5.5): 128467.49
ACD/LogD (pH 7.4): 6.86
ACD/BCF (pH 7.4): 96289.98
ACD/KOC (pH 7.4): 128477.09
Polar Surface Area: 76 Å2
Polarizability: 63.0±0.5 10-24cm3
Surface Tension: 39.0±7.0 dyne/cm
Molar Volume: 493.6±7.0 cm3

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