ChemSpider 2D Image | 4-Acetyl-N-{3-[(3,5-dinitrobenzoyl)amino]propyl}-1-piperazinecarboxamide | C17H22N6O7

4-Acetyl-N-{3-[(3,5-dinitrobenzoyl)amino]propyl}-1-piperazinecarboxamide

  • Molecular FormulaC17H22N6O7
  • Average mass422.393 Da
  • Monoisotopic mass422.154999 Da
  • ChemSpider ID59598234

More details:

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

1-Piperazinecarboxamide, 4-acetyl-N-[3-[(3,5-dinitrobenzoyl)amino]propyl]- [ACD/Index Name]
4-Acetyl-N-{3-[(3,5-dinitrobenzoyl)amino]propyl}-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-Acetyl-N-{3-[(3,5-dinitrobenzoyl)amino]propyl}-1-piperazinecarboxamide [ACD/IUPAC Name]
4-Acétyl-N-{3-[(3,5-dinitrobenzoyl)amino]propyl}-1-pipérazinecarboxamide [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: 728.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 394.2±32.9 °C
Index of Refraction: 1.600
Molar Refractivity: 103.1±0.3 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.02
ACD/LogD (pH 5.5): 0.37
ACD/BCF (pH 5.5): 1.13
ACD/KOC (pH 5.5): 38.02
ACD/LogD (pH 7.4): 0.37
ACD/BCF (pH 7.4): 1.13
ACD/KOC (pH 7.4): 38.02
Polar Surface Area: 173 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 64.4±3.0 dyne/cm
Molar Volume: 301.3±3.0 cm3

Click to predict properties on the Chemicalize site


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