ChemSpider 2D Image | N~2~-(2-Bromo-3,4,5-trimethoxybenzoyl)-N-(3-methylphenyl)-N-(3-pyridinylmethyl)leucinamide | C29H34BrN3O5

N2-(2-Bromo-3,4,5-trimethoxybenzoyl)-N-(3-methylphenyl)-N-(3-pyridinylmethyl)leucinamide

  • Molecular FormulaC29H34BrN3O5
  • Average mass584.501 Da
  • Monoisotopic mass583.168152 Da
  • ChemSpider ID122214874

More details:

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

Benzamide, 2-bromo-3,4,5-trimethoxy-N-[3-methyl-1-[[(3-methylphenyl)(3-pyridinylmethyl)amino]carbonyl]butyl]- [ACD/Index Name]
N2-(2-Brom-3,4,5-trimethoxybenzoyl)-N-(3-methylphenyl)-N-(3-pyridinylmethyl)leucinamid [German] [ACD/IUPAC Name]
N2-(2-Bromo-3,4,5-trimethoxybenzoyl)-N-(3-methylphenyl)-N-(3-pyridinylmethyl)leucinamide [ACD/IUPAC Name]
N2-(2-Bromo-3,4,5-triméthoxybenzoyl)-N-(3-méthylphényl)-N-(3-pyridinylméthyl)leucinamide [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: 647.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 345.1±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 152.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 3.85
ACD/BCF (pH 5.5): 487.20
ACD/KOC (pH 5.5): 2865.29
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 520.58
ACD/KOC (pH 7.4): 3061.61
Polar Surface Area: 90 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 451.0±3.0 cm3

Click to predict properties on the Chemicalize site


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