ChemSpider 2D Image | N-[2-(1H-Benzimidazol-2-yl)ethyl]-1-(2-furylmethyl)-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide | C27H22N6O2

N-[2-(1H-Benzimidazol-2-yl)ethyl]-1-(2-furylmethyl)-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

  • Molecular FormulaC27H22N6O2
  • Average mass462.503 Da
  • Monoisotopic mass462.180420 Da
  • ChemSpider ID30601141

More details:

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

1H-Pyrazolo[3,4-b]pyridine-4-carboxamide, N-[2-(1H-benzimidazol-2-yl)ethyl]-1-(2-furanylmethyl)-6-phenyl- [ACD/Index Name]
N-[2-(1H-Benzimidazol-2-yl)ethyl]-1-(2-furylmethyl)-6-phenyl-1H-pyrazolo[3,4-b]pyridin-4-carboxamid [German] [ACD/IUPAC Name]
N-[2-(1H-Benzimidazol-2-yl)ethyl]-1-(2-furylmethyl)-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [ACD/IUPAC Name]
N-[2-(1H-Benzimidazol-2-yl)éthyl]-1-(2-furylméthyl)-6-phényl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 807.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.3±3.0 kJ/mol
Flash Point: 441.9±34.3 °C
Index of Refraction: 1.730
Molar Refractivity: 133.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 59.86
ACD/KOC (pH 5.5): 497.68
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 151.09
ACD/KOC (pH 7.4): 1256.21
Polar Surface Area: 102 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 59.2±7.0 dyne/cm
Molar Volume: 333.8±7.0 cm3

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