ChemSpider 2D Image | N-{6-[3-(4-Acetyl-1-piperazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-3-nitrobenzamide | C19H21N7O6

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

  • Molecular FormulaC19H21N7O6
  • Average mass443.413 Da
  • Monoisotopic mass443.155334 Da
  • ChemSpider ID66807396

More details:






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

Benzamide, N-[6-[3-(4-acetyl-1-piperazinyl)-3-oxopropyl]-4,5-dihydro-5-oxo-1,2,4-triazin-3-yl]-3-nitro- [ACD/Index Name]
N-{6-[3-(4-Acetyl-1-piperazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-3-nitrobenzamid [German] [ACD/IUPAC Name]
N-{6-[3-(4-Acetyl-1-piperazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-3-nitrobenzamide [ACD/IUPAC Name]
N-{6-[3-(4-Acétyl-1-pipérazinyl)-3-oxopropyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}-3-nitrobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.706
Molar Refractivity: 111.5±0.5 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -1.71
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.19
ACD/LogD (pH 7.4): -0.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.57
Polar Surface Area: 169 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 70.8±7.0 dyne/cm
Molar Volume: 286.7±7.0 cm3

Click to predict properties on the Chemicalize site






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