ChemSpider 2D Image | N-[3-(5-Amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-6-bromo-1H-indole-2-carboxamide | C22H19BrN6O

N-[3-(5-Amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-6-bromo-1H-indole-2-carboxamide

  • Molecular FormulaC22H19BrN6O
  • Average mass463.330 Da
  • Monoisotopic mass462.080353 Da
  • ChemSpider ID33718874

More details:

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

1H-Indole-2-carboxamide, N-[3-(5-amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-6-bromo- [ACD/Index Name]
N-[3-(5-Amino-4-cyan-1-phenyl-1H-pyrazol-3-yl)propyl]-6-brom-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
N-[3-(5-Amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-6-bromo-1H-indole-2-carboxamide [ACD/IUPAC Name]
N-[3-(5-Amino-4-cyano-1-phényl-1H-pyrazol-3-yl)propyl]-6-bromo-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 784.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 428.1±32.9 °C
Index of Refraction: 1.722
Molar Refractivity: 119.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 444.09
ACD/KOC (pH 5.5): 2733.14
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 444.09
ACD/KOC (pH 7.4): 2733.14
Polar Surface Area: 113 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 61.3±7.0 dyne/cm
Molar Volume: 300.8±7.0 cm3

Click to predict properties on the Chemicalize site


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