ChemSpider 2D Image | 3-Oxo-N-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide | C21H23F3N6O2

3-Oxo-N-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide

  • Molecular FormulaC21H23F3N6O2
  • Average mass448.441 Da
  • Monoisotopic mass448.183472 Da
  • ChemSpider ID30407486

More details:

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

1,2,4-Triazolo[4,3-a]pyridine-8-carboxamide, 2,3-dihydro-3-oxo-N-[3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propyl]- [ACD/Index Name]
3-Oxo-N-(3-{4-[3-(trifluormethyl)phenyl]-1-piperazinyl}propyl)-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridin-8-carboxamid [German] [ACD/IUPAC Name]
3-Oxo-N-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide [ACD/IUPAC Name]
3-Oxo-N-(3-{4-[3-(trifluorométhyl)phényl]-1-pipérazinyl}propyl)-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-8-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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.639
Molar Refractivity: 112.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.73
ACD/LogD (pH 7.4): 0.74
ACD/BCF (pH 7.4): 1.53
ACD/KOC (pH 7.4): 31.88
Polar Surface Area: 80 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 311.4±7.0 cm3

Click to predict properties on the Chemicalize site


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