ChemSpider 2D Image | 2-{[1-(2-Fluorobenzyl)-2-(isopropylsulfonyl)-1H-imidazol-5-yl]methyl}-1,2-oxazinane | C18H24FN3O3S

2-{[1-(2-Fluorobenzyl)-2-(isopropylsulfonyl)-1H-imidazol-5-yl]methyl}-1,2-oxazinane

  • Molecular FormulaC18H24FN3O3S
  • Average mass381.465 Da
  • Monoisotopic mass381.152252 Da
  • ChemSpider ID22172247

More details:

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

2-{[1-(2-Fluorbenzyl)-2-(isopropylsulfonyl)-1H-imidazol-5-yl]methyl}-1,2-oxazinan [German] [ACD/IUPAC Name]
2-{[1-(2-Fluorobenzyl)-2-(isopropylsulfonyl)-1H-imidazol-5-yl]methyl}-1,2-oxazinane [ACD/IUPAC Name]
2-{[1-(2-Fluorobenzyl)-2-(isopropylsulfonyl)-1H-imidazol-5-yl]méthyl}-1,2-oxazinane [French] [ACD/IUPAC Name]
2H-1,2-Oxazine, 2-[[1-[(2-fluorophenyl)methyl]-2-[(1-methylethyl)sulfonyl]-1H-imidazol-5-yl]methyl]tetrahydro- [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: 548.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 285.2±32.9 °C
Index of Refraction: 1.599
Molar Refractivity: 99.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 24.75
ACD/KOC (pH 5.5): 345.97
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 24.75
ACD/KOC (pH 7.4): 346.10
Polar Surface Area: 73 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 46.1±7.0 dyne/cm
Molar Volume: 291.0±7.0 cm3

Click to predict properties on the Chemicalize site


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