ChemSpider 2D Image | N-(3-Acetylphenyl)-2-(4-{4-[4-(hydroxymethyl)phenyl]-6-({methyl[2-(2-pyridinyl)ethyl]amino}methyl)-1,3-dioxan-2-yl}phenyl)acetamide | C36H39N3O5

N-(3-Acetylphenyl)-2-(4-{4-[4-(hydroxymethyl)phenyl]-6-({methyl[2-(2-pyridinyl)ethyl]amino}methyl)-1,3-dioxan-2-yl}phenyl)acetamide

  • Molecular FormulaC36H39N3O5
  • Average mass593.712 Da
  • Monoisotopic mass593.289001 Da
  • ChemSpider ID2571287

More details:

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

Benzeneacetamide, N-(3-acetylphenyl)-4-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl[2-(2-pyridinyl)ethyl]amino]methyl]-1,3-dioxan-2-yl]- [ACD/Index Name]
N-(3-Acetylphenyl)-2-(4-{4-[4-(hydroxymethyl)phenyl]-6-({methyl[2-(2-pyridinyl)ethyl]amino}methyl)-1,3-dioxan-2-yl}phenyl)acetamid [German] [ACD/IUPAC Name]
N-(3-Acetylphenyl)-2-(4-{4-[4-(hydroxymethyl)phenyl]-6-({methyl[2-(2-pyridinyl)ethyl]amino}methyl)-1,3-dioxan-2-yl}phenyl)acetamide [ACD/IUPAC Name]
N-(3-Acétylphényl)-2-(4-{4-[4-(hydroxyméthyl)phényl]-6-({méthyl[2-(2-pyridinyl)éthyl]amino}méthyl)-1,3-dioxan-2-yl}phényl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 823.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.5±3.0 kJ/mol
Flash Point: 452.1±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 170.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 4.18
ACD/KOC (pH 5.5): 17.94
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 212.70
ACD/KOC (pH 7.4): 911.68
Polar Surface Area: 101 Å2
Polarizability: 67.7±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 487.8±3.0 cm3

Click to predict properties on the Chemicalize site


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