ChemSpider 2D Image | N-{1-[(1R)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide | C25H26N8O

N-{1-[(1R)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide

  • Molecular FormulaC25H26N8O
  • Average mass454.527 Da
  • Monoisotopic mass454.222961 Da
  • ChemSpider ID34258355
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1H-Indazole-3-carboxamide, N-[1-[(1R)-3-(dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl]-6-(1H-pyrazol-4-yl)- [ACD/Index Name]
N-{1-[(1R)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6-(1H-pyrazol-4-yl)-1H-indazol-3-carboxamid [German] [ACD/IUPAC Name]
N-{1-[(1R)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide [ACD/IUPAC Name]
N-{1-[(1R)-3-(Diméthylamino)-1-phénylpropyl]-1H-pyrazol-4-yl}-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide [French] [ACD/IUPAC Name]
2VW

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 694.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.7±3.0 kJ/mol
Flash Point: 373.8±31.5 °C
Index of Refraction: 1.709
Molar Refractivity: 131.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.40
Polar Surface Area: 108 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 56.0±7.0 dyne/cm
Molar Volume: 337.4±7.0 cm3

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