ChemSpider 2D Image | 2,4-Dimethoxy-N-{3-methyl-1-[3-methyl-4-(3,5,5-trimethylhexanoyl)-1-piperazinyl]-1-oxo-2-butanyl}benzamide | C28H45N3O5

2,4-Dimethoxy-N-{3-methyl-1-[3-methyl-4-(3,5,5-trimethylhexanoyl)-1-piperazinyl]-1-oxo-2-butanyl}benzamide

  • Molecular FormulaC28H45N3O5
  • Average mass503.674 Da
  • Monoisotopic mass503.335907 Da
  • ChemSpider ID22589785

More details:

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

2,4-Dimethoxy-N-{3-methyl-1-[3-methyl-4-(3,5,5-trimethylhexanoyl)-1-piperazinyl]-1-oxo-2-butanyl}benzamid [German] [ACD/IUPAC Name]
2,4-Dimethoxy-N-{3-methyl-1-[3-methyl-4-(3,5,5-trimethylhexanoyl)-1-piperazinyl]-1-oxo-2-butanyl}benzamide [ACD/IUPAC Name]
2,4-Diméthoxy-N-{3-méthyl-1-[3-méthyl-4-(3,5,5-triméthylhexanoyl)-1-pipérazinyl]-1-oxo-2-butanyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 2,4-dimethoxy-N-[2-methyl-1-[[3-methyl-4-(3,5,5-trimethyl-1-oxohexyl)-1-piperazinyl]carbonyl]propyl]- [ACD/Index 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: 663.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 355.2±31.5 °C
Index of Refraction: 1.514
Molar Refractivity: 141.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.56
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 566.50
ACD/KOC (pH 5.5): 3253.45
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 566.50
ACD/KOC (pH 7.4): 3253.45
Polar Surface Area: 88 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 39.4±3.0 dyne/cm
Molar Volume: 470.1±3.0 cm3

Click to predict properties on the Chemicalize site


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