ChemSpider 2D Image | 2-[4-(1-Methyl-4-nitro-1H-imidazol-5-yl)-1-piperazinyl]-1-(4-morpholinyl)ethanone | C14H22N6O4

2-[4-(1-Methyl-4-nitro-1H-imidazol-5-yl)-1-piperazinyl]-1-(4-morpholinyl)ethanone

  • Molecular FormulaC14H22N6O4
  • Average mass338.362 Da
  • Monoisotopic mass338.170258 Da
  • ChemSpider ID26168381

More details:

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

2-[4-(1-Methyl-4-nitro-1H-imidazol-5-yl)-1-piperazinyl]-1-(4-morpholinyl)ethanon [German] [ACD/IUPAC Name]
2-[4-(1-Methyl-4-nitro-1H-imidazol-5-yl)-1-piperazinyl]-1-(4-morpholinyl)ethanone [ACD/IUPAC Name]
2-[4-(1-Méthyl-4-nitro-1H-imidazol-5-yl)-1-pipérazinyl]-1-(4-morpholinyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-[4-(1-methyl-4-nitro-1H-imidazol-5-yl)-1-piperazinyl]-1-(4-morpholinyl)- [ACD/Index Name]
2-[4-(1-METHYL-4-NITRO-1H-IMIDAZOL-5-YL)PIPERAZIN-1-YL]-1-(MORPHOLIN-4-YL)ETHAN-1-ONE
2-[4-(3-METHYL-5-NITROIMIDAZOL-4-YL)PIPERAZIN-1-YL]-1-(MORPHOLIN-4-YL)ETHANONE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 615.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.3±3.0 kJ/mol
Flash Point: 325.8±31.5 °C
Index of Refraction: 1.676
Molar Refractivity: 86.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.57
ACD/LogD (pH 5.5): -0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.63
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.17
Polar Surface Area: 100 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 65.2±7.0 dyne/cm
Molar Volume: 228.6±7.0 cm3

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