ChemSpider 2D Image | Benzyl [2-oxo-2-(4-{6-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethyl]carbamate | C27H37N7O4

Benzyl [2-oxo-2-(4-{6-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethyl]carbamate

  • Molecular FormulaC27H37N7O4
  • Average mass523.627 Da
  • Monoisotopic mass523.290710 Da
  • ChemSpider ID58476286

More details:

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

[2-Oxo-2-(4-{6-[4-(tétrahydro-2-furanylméthyl)-1-pipérazinyl]-3-pyridazinyl}-1-pipérazinyl)éthyl]carbamate de benzyle [French] [ACD/IUPAC Name]
Benzyl [2-oxo-2-(4-{6-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethyl]carbamate [ACD/IUPAC Name]
Benzyl-[2-oxo-2-(4-{6-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-oxo-2-[4-[6-[4-[(tetrahydro-2-furanyl)methyl]-1-piperazinyl]-3-pyridazinyl]-1-piperazinyl]ethyl]-, phenylmethyl ester [ACD/Index Name]
benzyl (2-oxo-2-(4-(6-(4-((tetrahydrofuran-2-yl)methyl)piperazin-1-yl)pyridazin-3-yl)piperazin-1-yl)ethyl)carbamate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 806.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.3±3.0 kJ/mol
Flash Point: 441.7±34.3 °C
Index of Refraction: 1.598
Molar Refractivity: 141.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 0.72
ACD/LogD (pH 5.5): -0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.56
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 4.06
ACD/KOC (pH 7.4): 80.93
Polar Surface Area: 103 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 413.2±3.0 cm3

Click to predict properties on the Chemicalize site


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