ChemSpider 2D Image | 2,2-Dimethyl-N-(3-methylbutyl)-N-{[3-methyl-5-(4-methyl-1-piperazinyl)-1-phenyl-1H-pyrazol-4-yl]methyl}propanamide | C26H41N5O

2,2-Dimethyl-N-(3-methylbutyl)-N-{[3-methyl-5-(4-methyl-1-piperazinyl)-1-phenyl-1H-pyrazol-4-yl]methyl}propanamide

  • Molecular FormulaC26H41N5O
  • Average mass439.637 Da
  • Monoisotopic mass439.331116 Da
  • ChemSpider ID22742422

More details:

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

2,2-Dimethyl-N-(3-methylbutyl)-N-{[3-methyl-5-(4-methyl-1-piperazinyl)-1-phenyl-1H-pyrazol-4-yl]methyl}propanamid [German] [ACD/IUPAC Name]
2,2-Dimethyl-N-(3-methylbutyl)-N-{[3-methyl-5-(4-methyl-1-piperazinyl)-1-phenyl-1H-pyrazol-4-yl]methyl}propanamide [ACD/IUPAC Name]
2,2-Diméthyl-N-(3-méthylbutyl)-N-{[3-méthyl-5-(4-méthyl-1-pipérazinyl)-1-phényl-1H-pyrazol-4-yl]méthyl}propanamide [French] [ACD/IUPAC Name]
Propanamide, 2,2-dimethyl-N-(3-methylbutyl)-N-[[3-methyl-5-(4-methyl-1-piperazinyl)-1-phenyl-1H-pyrazol-4-yl]methyl]- [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: 587.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 308.9±30.1 °C
Index of Refraction: 1.566
Molar Refractivity: 133.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 5.63
ACD/KOC (pH 5.5): 26.80
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 327.32
ACD/KOC (pH 7.4): 1557.06
Polar Surface Area: 45 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 38.1±7.0 dyne/cm
Molar Volume: 409.7±7.0 cm3

Click to predict properties on the Chemicalize site


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