ChemSpider 2D Image | 1-(2-Fluorophenyl)-5-(1H-pyrrol-1-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazole-4-carboxamide | C21H16FN7O

1-(2-Fluorophenyl)-5-(1H-pyrrol-1-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazole-4-carboxamide

  • Molecular FormulaC21H16FN7O
  • Average mass401.396 Da
  • Monoisotopic mass401.140045 Da
  • ChemSpider ID30058376

More details:

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

1-(2-Fluorophenyl)-5-(1H-pyrrol-1-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
1-(2-Fluorophényl)-5-(1H-pyrrol-1-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylméthyl)-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
1-(2-Fluorphenyl)-5-(1H-pyrrol-1-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
1H-Pyrazole-4-carboxamide, 1-(2-fluorophenyl)-5-(1H-pyrrol-1-yl)-N-(1,2,4-triazolo[4,3-a]pyridin-3-ylmethyl)- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.729
Molar Refractivity: 111.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.30
ACD/KOC (pH 5.5): 256.27
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.00
ACD/KOC (pH 7.4): 220.11
Polar Surface Area: 82 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 60.4±7.0 dyne/cm
Molar Volume: 279.3±7.0 cm3

Click to predict properties on the Chemicalize site


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