ChemSpider 2D Image | N-(3-Chloro-4-methylphenyl)-2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonamide | C18H14ClF3N2O4S

N-(3-Chloro-4-methylphenyl)-2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonamide

  • Molecular FormulaC18H14ClF3N2O4S
  • Average mass446.828 Da
  • Monoisotopic mass446.031494 Da
  • ChemSpider ID21780554

More details:

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

Benzenesulfonamide, N-(3-chloro-4-methylphenyl)-2-methoxy-5-[5-(trifluoromethyl)-3-isoxazolyl]- [ACD/Index Name]
N-(3-Chlor-4-methylphenyl)-2-methoxy-5-[5-(trifluormethyl)-1,2-oxazol-3-yl]benzolsulfonamid [German] [ACD/IUPAC Name]
N-(3-Chloro-4-methylphenyl)-2-methoxy-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzenesulfonamide [ACD/IUPAC Name]
N-(3-Chloro-4-méthylphényl)-2-méthoxy-5-[5-(trifluorométhyl)-1,2-oxazol-3-yl]benzènesulfonamide [French] [ACD/IUPAC Name]
4-allyl-2-[4-(2-methoxybenzoyl)piperazin-1-yl]pyrido[2,3-b]pyrazin-3(4H)-one

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

Density: 1.5±0.1 g/cm3
Boiling Point: 583.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 306.9±32.9 °C
Index of Refraction: 1.566
Molar Refractivity: 99.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1184.60
ACD/KOC (pH 5.5): 5477.69
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 410.54
ACD/KOC (pH 7.4): 1898.37
Polar Surface Area: 90 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 305.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement