ChemSpider 2D Image | 3-{6-[3-(4-Acetyl-1-piperazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-1,1-diethylurea | C17H27N7O4

3-{6-[3-(4-Acetyl-1-piperazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-1,1-diethylurea

  • Molecular FormulaC17H27N7O4
  • Average mass393.441 Da
  • Monoisotopic mass393.212463 Da
  • ChemSpider ID66920765

More details:

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

3-{6-[3-(4-Acetyl-1-piperazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-1,1-diethylharnstoff [German] [ACD/IUPAC Name]
3-{6-[3-(4-Acetyl-1-piperazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-1,1-diethylurea [ACD/IUPAC Name]
3-{6-[3-(4-Acétyl-1-pipérazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-1,1-diéthylurée [French] [ACD/IUPAC Name]
Urea, N'-[6-[3-(4-acetyl-1-piperazinyl)-3-oxopropyl]-4,5-dihydro-5-oxo-1,2,4-triazin-3-yl]-N,N-diethyl- [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: 1.635
Molar Refractivity: 102.7±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.52
ACD/LogD (pH 5.5): -0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.13
ACD/LogD (pH 7.4): -0.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.76
Polar Surface Area: 127 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 55.4±7.0 dyne/cm
Molar Volume: 286.9±7.0 cm3

Click to predict properties on the Chemicalize site


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