ChemSpider 2D Image | N-(4-Fluorobenzyl)-2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonamide | C18H14F4N2O3S

N-(4-Fluorobenzyl)-2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonamide

  • Molecular FormulaC18H14F4N2O3S
  • Average mass414.374 Da
  • Monoisotopic mass414.066132 Da
  • ChemSpider ID21780524

More details:

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

Benzenesulfonamide, N-[(4-fluorophenyl)methyl]-2-methyl-5-[5-(trifluoromethyl)-3-isoxazolyl]- [ACD/Index Name]
N-(4-Fluorbenzyl)-2-methyl-5-[5-(trifluormethyl)-1,2-oxazol-3-yl]benzolsulfonamid [German] [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonamide [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-2-méthyl-5-[5-(trifluorométhyl)-1,2-oxazol-3-yl]benzènesulfonamide [French] [ACD/IUPAC Name]
N-(3-morpholin-4-ylpropyl)-5-[4-(pyrrolidin-1-ylsulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 557.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 290.8±32.9 °C
Index of Refraction: 1.543
Molar Refractivity: 93.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 501.20
ACD/KOC (pH 5.5): 2980.34
ACD/LogD (pH 7.4): 3.85
ACD/BCF (pH 7.4): 499.99
ACD/KOC (pH 7.4): 2973.19
Polar Surface Area: 81 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 296.0±3.0 cm3

Click to predict properties on the Chemicalize site


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