ChemSpider 2D Image | N-{[4-(4,9-Diethoxy-1-oxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzyl]sulfonyl}-2-mesitylacetamide | C34H36N2O6S

N-{[4-(4,9-Diethoxy-1-oxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzyl]sulfonyl}-2-mesitylacetamide

  • Molecular FormulaC34H36N2O6S
  • Average mass600.724 Da
  • Monoisotopic mass600.229431 Da
  • ChemSpider ID23321527

More details:

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

Benzeneacetamide, N-[[[4-(4,9-diethoxy-1,3-dihydro-1-oxo-2H-benz[f]isoindol-2-yl)phenyl]methyl]sulfonyl]-2,4,6-trimethyl- [ACD/Index Name]
N-{[4-(4,9-diethoxy-1-oxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzyl]sulfonyl}-2-(2,4,6-trimethylphenyl)acetamide
N-{[4-(4,9-Diethoxy-1-oxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzyl]sulfonyl}-2-mesitylacetamid [German] [ACD/IUPAC Name]
N-{[4-(4,9-Diethoxy-1-oxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzyl]sulfonyl}-2-mesitylacetamide [ACD/IUPAC Name]
N-{[4-(4,9-Diéthoxy-1-oxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzyl]sulfonyl}-2-mésitylacétamide [French] [ACD/IUPAC Name]
C-[4-(4,9-diethoxy-1-oxo-1,3-dihydro-benzo[f]isoindol-2-yl)-phenyl]-N-[2-(2,4,6-trimethyl-phenyl)-acetyl]-methanesulfonamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL271070/

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.628
Molar Refractivity: 167.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.69
ACD/LogD (pH 5.5): 4.53
ACD/BCF (pH 5.5): 727.93
ACD/KOC (pH 5.5): 1488.93
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 220.85
ACD/KOC (pH 7.4): 451.73
Polar Surface Area: 110 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 471.2±3.0 cm3

Click to predict properties on the Chemicalize site


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