ChemSpider 2D Image | 2-{[1-(2-Acetamidoethyl)-6-{[ethyl(2-hydroxyethyl)amino]methyl}-4-oxo-1,4-dihydro-3-pyridinyl]oxy}-N-[2-(diethylamino)ethyl]acetamide | C22H39N5O5

2-{[1-(2-Acetamidoethyl)-6-{[ethyl(2-hydroxyethyl)amino]methyl}-4-oxo-1,4-dihydro-3-pyridinyl]oxy}-N-[2-(diethylamino)ethyl]acetamide

  • Molecular FormulaC22H39N5O5
  • Average mass453.576 Da
  • Monoisotopic mass453.295105 Da
  • ChemSpider ID124069190

More details:

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

2-{[1-(2-Acetamidoethyl)-6-{[ethyl(2-hydroxyethyl)amino]methyl}-4-oxo-1,4-dihydro-3-pyridinyl]oxy}-N-[2-(diethylamino)ethyl]acetamid [German] [ACD/IUPAC Name]
2-{[1-(2-Acetamidoethyl)-6-{[ethyl(2-hydroxyethyl)amino]methyl}-4-oxo-1,4-dihydro-3-pyridinyl]oxy}-N-[2-(diethylamino)ethyl]acetamide [ACD/IUPAC Name]
2-{[1-(2-Acétamidoéthyl)-6-{[éthyl(2-hydroxyéthyl)amino]méthyl}-4-oxo-1,4-dihydro-3-pyridinyl]oxy}-N-[2-(diéthylamino)éthyl]acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[1-[2-(acetylamino)ethyl]-6-[[ethyl(2-hydroxyethyl)amino]methyl]-1,4-dihydro-4-oxo-3-pyridinyl]oxy]-N-[2-(diethylamino)ethyl]- [ACD/Index 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: 709.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.6±6.0 kJ/mol
Flash Point: 383.0±32.9 °C
Index of Refraction: 1.555
Molar Refractivity: 123.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: -0.56
ACD/LogD (pH 5.5): -4.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 114 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 385.6±5.0 cm3

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