ChemSpider 2D Image | (4-{[4-(2-Methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)[4-(5-nitro-2-pyridinyl)-1-piperazinyl]methanone | C24H32N6O5S

(4-{[4-(2-Methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)[4-(5-nitro-2-pyridinyl)-1-piperazinyl]methanone

  • Molecular FormulaC24H32N6O5S
  • Average mass516.613 Da
  • Monoisotopic mass516.215515 Da
  • ChemSpider ID66468128

More details:

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

(4-{[4-(2-Methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)[4-(5-nitro-2-pyridinyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
(4-{[4-(2-Methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)[4-(5-nitro-2-pyridinyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(4-{[4-(2-Méthyl-2-propanyl)phényl]sulfonyl}-1-pipérazinyl)[4-(5-nitro-2-pyridinyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [4-[[4-(1,1-dimethylethyl)phenyl]sulfonyl]-1-piperazinyl][4-(5-nitro-2-pyridinyl)-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 693.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.6±3.0 kJ/mol
Flash Point: 373.4±34.3 °C
Index of Refraction: 1.618
Molar Refractivity: 135.9±0.4 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 330.36
ACD/KOC (pH 5.5): 2163.90
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 356.32
ACD/KOC (pH 7.4): 2333.94
Polar Surface Area: 131 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 387.7±3.0 cm3

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