ChemSpider 2D Image | N-[4-Cyano-1-(4-methyl-2-quinolinyl)-1H-pyrazol-5-yl]-4-(1H-pyrrol-1-yl)benzamide | C25H18N6O

N-[4-Cyano-1-(4-methyl-2-quinolinyl)-1H-pyrazol-5-yl]-4-(1H-pyrrol-1-yl)benzamide

  • Molecular FormulaC25H18N6O
  • Average mass418.450 Da
  • Monoisotopic mass418.154205 Da
  • ChemSpider ID34562976

More details:

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

Benzamide, N-[4-cyano-1-(4-methyl-2-quinolinyl)-1H-pyrazol-5-yl]-4-(1H-pyrrol-1-yl)- [ACD/Index Name]
N-[4-Cyan-1-(4-methyl-2-chinolinyl)-1H-pyrazol-5-yl]-4-(1H-pyrrol-1-yl)benzamid [German] [ACD/IUPAC Name]
N-[4-Cyano-1-(4-méthyl-2-quinoléinyl)-1H-pyrazol-5-yl]-4-(1H-pyrrol-1-yl)benzamide [French] [ACD/IUPAC Name]
N-[4-Cyano-1-(4-methyl-2-quinolinyl)-1H-pyrazol-5-yl]-4-(1H-pyrrol-1-yl)benzamide [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 615.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.3±3.0 kJ/mol
Flash Point: 325.8±31.5 °C
Index of Refraction: 1.704
Molar Refractivity: 124.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 466.82
ACD/KOC (pH 5.5): 2832.51
ACD/LogD (pH 7.4): 3.82
ACD/BCF (pH 7.4): 466.65
ACD/KOC (pH 7.4): 2831.49
Polar Surface Area: 89 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 56.1±7.0 dyne/cm
Molar Volume: 321.0±7.0 cm3

Click to predict properties on the Chemicalize site


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