ChemSpider 2D Image | 2-({6-({[4-(Diethylamino)-2-methylphenyl]amino}methyl)-1-[3-(diethylamino)propyl]-4-oxo-1,4-dihydro-3-pyridinyl}oxy)-N-isopropylacetamide | C29H47N5O3

2-({6-({[4-(Diethylamino)-2-methylphenyl]amino}methyl)-1-[3-(diethylamino)propyl]-4-oxo-1,4-dihydro-3-pyridinyl}oxy)-N-isopropylacetamide

  • Molecular FormulaC29H47N5O3
  • Average mass513.715 Da
  • Monoisotopic mass513.367920 Da
  • ChemSpider ID123819186

More details:

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

2-({6-({[4-(Diethylamino)-2-methylphenyl]amino}methyl)-1-[3-(diethylamino)propyl]-4-oxo-1,4-dihydro-3-pyridinyl}oxy)-N-isopropylacetamid [German] [ACD/IUPAC Name]
2-({6-({[4-(Diethylamino)-2-methylphenyl]amino}methyl)-1-[3-(diethylamino)propyl]-4-oxo-1,4-dihydro-3-pyridinyl}oxy)-N-isopropylacetamide [ACD/IUPAC Name]
2-({6-({[4-(Diéthylamino)-2-méthylphényl]amino}méthyl)-1-[3-(diéthylamino)propyl]-4-oxo-1,4-dihydro-3-pyridinyl}oxy)-N-isopropylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[6-[[[4-(diethylamino)-2-methylphenyl]amino]methyl]-1-[3-(diethylamino)propyl]-1,4-dihydro-4-oxo-3-pyridinyl]oxy]-N-(1-methylethyl)- [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: 709.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.8±3.0 kJ/mol
Flash Point: 383.0±32.9 °C
Index of Refraction: 1.564
Molar Refractivity: 151.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 4.10
ACD/LogD (pH 5.5): -0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 77 Å2
Polarizability: 60.0±0.5 10-24cm3
Surface Tension: 47.7±5.0 dyne/cm
Molar Volume: 465.7±5.0 cm3

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