ChemSpider 2D Image | N-[2-(Dimethylamino)-5-(heptanoylamino)benzyl]-N-isobutyl-3-methylbenzamide | C28H41N3O2

N-[2-(Dimethylamino)-5-(heptanoylamino)benzyl]-N-isobutyl-3-methylbenzamide

  • Molecular FormulaC28H41N3O2
  • Average mass451.644 Da
  • Monoisotopic mass451.319885 Da
  • ChemSpider ID22794906

More details:

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

Benzamide, N-[[2-(dimethylamino)-5-[(1-oxoheptyl)amino]phenyl]methyl]-3-methyl-N-(2-methylpropyl)- [ACD/Index Name]
N-[2-(Dimethylamino)-5-(heptanoylamino)benzyl]-N-isobutyl-3-methylbenzamid [German] [ACD/IUPAC Name]
N-[2-(Dimethylamino)-5-(heptanoylamino)benzyl]-N-isobutyl-3-methylbenzamide [ACD/IUPAC Name]
N-[2-(Diméthylamino)-5-(heptanoylamino)benzyl]-N-isobutyl-3-méthylbenzamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 652.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 348.4±31.5 °C
Index of Refraction: 1.570
Molar Refractivity: 139.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 5.46
ACD/BCF (pH 5.5): 5967.00
ACD/KOC (pH 5.5): 11839.46
ACD/LogD (pH 7.4): 6.05
ACD/BCF (pH 7.4): 22962.07
ACD/KOC (pH 7.4): 45560.34
Polar Surface Area: 53 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 425.2±3.0 cm3

Click to predict properties on the Chemicalize site


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