ChemSpider 2D Image | (2E)-N-(3-Benzoyl-4-{[(4-methylphenyl)acetyl]amino}phenyl)-3-{5-[4-(methylsulfonyl)phenyl]-2-furyl}acrylamide | C36H30N2O6S

(2E)-N-(3-Benzoyl-4-{[(4-methylphenyl)acetyl]amino}phenyl)-3-{5-[4-(methylsulfonyl)phenyl]-2-furyl}acrylamide

  • Molecular FormulaC36H30N2O6S
  • Average mass618.698 Da
  • Monoisotopic mass618.182434 Da
  • ChemSpider ID8207363

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-(3-Benzoyl-4-{[(4-methylphenyl)acetyl]amino}phenyl)-3-{5-[4-(methylsulfonyl)phenyl]-2-furyl}acrylamid [German] [ACD/IUPAC Name]
(2E)-N-(3-Benzoyl-4-{[(4-methylphenyl)acetyl]amino}phenyl)-3-{5-[4-(methylsulfonyl)phenyl]-2-furyl}acrylamide [ACD/IUPAC Name]
(2E)-N-(3-benzoyl-4-{[(4-methylphenyl)acetyl]amino}phenyl)-3-{5-[4-(methylsulfonyl)phenyl]furan-2-yl}prop-2-enamide
(2E)-N-(3-Benzoyl-4-{[2-(4-méthylphényl)acétyl]amino}phényl)-3-{5-[4-(méthylsulfonyl)phényl]-2-furyl}acrylamide [French] [ACD/IUPAC Name]
Benzeneacetamide, N-[2-benzoyl-4-[[(2E)-3-[5-[4-(methylsulfonyl)phenyl]-2-furanyl]-1-oxo-2-propen-1-yl]amino]phenyl]-4-methyl- [ACD/Index Name]
N-(3-benzoyl-4-(2-p-tolylacetamido)phenyl)-3-(5-(4-(methylsulfonyl)phenyl)furan-2-yl)acrylamide
N-[3-Benzoyl-4-(2-p-tolyl-acetylamino)-phenyl]-3-[(E)-5-(4-methanesulfonyl-phenyl)-furan-2-yl]-acrylamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 926.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.9±3.0 kJ/mol
Flash Point: 514.2±34.3 °C
Index of Refraction: 1.651
Molar Refractivity: 171.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.20
ACD/LogD (pH 5.5): 5.52
ACD/BCF (pH 5.5): 9270.81
ACD/KOC (pH 5.5): 24057.52
ACD/LogD (pH 7.4): 5.52
ACD/BCF (pH 7.4): 9270.83
ACD/KOC (pH 7.4): 24057.57
Polar Surface Area: 131 Å2
Polarizability: 68.0±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 469.4±3.0 cm3

Click to predict properties on the Chemicalize site


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