ChemSpider 2D Image | 2-{4-[6-(4-Fluorobenzyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]-1-piperazinyl}-N,N-dipropylacetamide | C22H31FN6O2

2-{4-[6-(4-Fluorobenzyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]-1-piperazinyl}-N,N-dipropylacetamide

  • Molecular FormulaC22H31FN6O2
  • Average mass430.519 Da
  • Monoisotopic mass430.249237 Da
  • ChemSpider ID67056327

More details:

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

1-Piperazineacetamide, 4-[6-[(4-fluorophenyl)methyl]-4,5-dihydro-5-oxo-1,2,4-triazin-3-yl]-N,N-dipropyl- [ACD/Index Name]
2-{4-[6-(4-Fluorbenzyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]-1-piperazinyl}-N,N-dipropylacetamid [German] [ACD/IUPAC Name]
2-{4-[6-(4-Fluorobenzyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]-1-piperazinyl}-N,N-dipropylacetamide [ACD/IUPAC Name]
2-{4-[6-(4-Fluorobenzyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]-1-pipérazinyl}-N,N-dipropylacétamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.607
Molar Refractivity: 118.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.99
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 3.65
ACD/KOC (pH 5.5): 59.21
ACD/LogD (pH 7.4): 1.80
ACD/BCF (pH 7.4): 13.61
ACD/KOC (pH 7.4): 220.73
Polar Surface Area: 81 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 46.8±7.0 dyne/cm
Molar Volume: 343.2±7.0 cm3

Click to predict properties on the Chemicalize site


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