ChemSpider 2D Image | N,N-Diethyl-2-{[4-(4-hydroxybenzyl)-1-(4-methoxybenzyl)-2-oxo-1,4-diazepan-6-yl]oxy}acetamide | C26H35N3O5

N,N-Diethyl-2-{[4-(4-hydroxybenzyl)-1-(4-methoxybenzyl)-2-oxo-1,4-diazepan-6-yl]oxy}acetamide

  • Molecular FormulaC26H35N3O5
  • Average mass469.573 Da
  • Monoisotopic mass469.257660 Da
  • ChemSpider ID22220743

More details:

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

Acetamide, N,N-diethyl-2-[[hexahydro-4-[(4-hydroxyphenyl)methyl]-1-[(4-methoxyphenyl)methyl]-2-oxo-1H-1,4-diazepin-6-yl]oxy]- [ACD/Index Name]
N,N-Diethyl-2-{[4-(4-hydroxybenzyl)-1-(4-methoxybenzyl)-2-oxo-1,4-diazepan-6-yl]oxy}acetamid [German] [ACD/IUPAC Name]
N,N-Diethyl-2-{[4-(4-hydroxybenzyl)-1-(4-methoxybenzyl)-2-oxo-1,4-diazepan-6-yl]oxy}acetamide [ACD/IUPAC Name]
N,N-Diéthyl-2-{[4-(4-hydroxybenzyl)-1-(4-méthoxybenzyl)-2-oxo-1,4-diazépan-6-yl]oxy}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: 668.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.8±3.0 kJ/mol
Flash Point: 358.3±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 131.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 12.34
ACD/KOC (pH 5.5): 179.65
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.16
ACD/KOC (pH 7.4): 308.18
Polar Surface Area: 83 Å2
Polarizability: 52.0±0.5 10-24cm3
Surface Tension: 57.6±5.0 dyne/cm
Molar Volume: 381.2±5.0 cm3

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