ChemSpider 2D Image | N-({1-Cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-2-phenyl-N-(tetrahydro-2-furanylmethyl)acetamide | C31H39N3O4S

N-({1-Cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-2-phenyl-N-(tetrahydro-2-furanylmethyl)acetamide

  • Molecular FormulaC31H39N3O4S
  • Average mass549.724 Da
  • Monoisotopic mass549.266113 Da
  • ChemSpider ID22637111

More details:

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

Benzeneacetamide, N-[[1-cyclohexyl-2-[[(3-methylphenyl)methyl]sulfonyl]-1H-imidazol-5-yl]methyl]-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
N-({1-Cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-2-phenyl-N-(tetrahydro-2-furanylmethyl)acetamid [German] [ACD/IUPAC Name]
N-({1-Cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-2-phenyl-N-(tetrahydro-2-furanylmethyl)acetamide [ACD/IUPAC Name]
N-({1-Cyclohexyl-2-[(3-méthylbenzyl)sulfonyl]-1H-imidazol-5-yl}méthyl)-2-phényl-N-(tétrahydro-2-furanylméthyl)acétamide [French] [ACD/IUPAC 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: 770.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 419.5±35.7 °C
Index of Refraction: 1.628
Molar Refractivity: 155.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2473.48
ACD/KOC (pH 5.5): 9343.84
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2473.48
ACD/KOC (pH 7.4): 9343.86
Polar Surface Area: 90 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 437.8±7.0 cm3

Click to predict properties on the Chemicalize site


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