ChemSpider 2D Image | 4-[(4-{[3-(3-Nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperazinyl)sulfonyl]morpholine | C17H22N6O6S

4-[(4-{[3-(3-Nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperazinyl)sulfonyl]morpholine

  • Molecular FormulaC17H22N6O6S
  • Average mass438.458 Da
  • Monoisotopic mass438.132141 Da
  • ChemSpider ID33703011

More details:

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

4-[(4-{[3-(3-Nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperazinyl)sulfonyl]morpholin [German] [ACD/IUPAC Name]
4-[(4-{[3-(3-Nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperazinyl)sulfonyl]morpholine [ACD/IUPAC Name]
4-[(4-{[3-(3-Nitrophényl)-1,2,4-oxadiazol-5-yl]méthyl}-1-pipérazinyl)sulfonyl]morpholine [French] [ACD/IUPAC Name]
Morpholine, 4-[[4-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]sulfonyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 646.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 345.1±34.3 °C
Index of Refraction: 1.667
Molar Refractivity: 105.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.13
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.32
ACD/KOC (pH 5.5): 42.20
ACD/LogD (pH 7.4): 0.47
ACD/BCF (pH 7.4): 1.34
ACD/KOC (pH 7.4): 42.90
Polar Surface Area: 146 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 85.1±5.0 dyne/cm
Molar Volume: 283.0±5.0 cm3

Click to predict properties on the Chemicalize site


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