ChemSpider 2D Image | N-(4-Fluorobenzyl)-N~2~-[(4-methoxyphenyl)acetyl]-N~2~-(3-methylbutyl)-N-[(4-oxo-4H-chromen-3-yl)methyl]glycinamide | C33H35FN2O5

N-(4-Fluorobenzyl)-N2-[(4-methoxyphenyl)acetyl]-N2-(3-methylbutyl)-N-[(4-oxo-4H-chromen-3-yl)methyl]glycinamide

  • Molecular FormulaC33H35FN2O5
  • Average mass558.640 Da
  • Monoisotopic mass558.252991 Da
  • ChemSpider ID3119281

More details:






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

Benzeneacetamide, N-[2-[[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-4-methoxy-N-(3-methylbutyl)- [ACD/Index Name]
N-(4-Fluorbenzyl)-N2-[(4-methoxyphenyl)acetyl]-N2-(3-methylbutyl)-N-[(4-oxo-4H-chromen-3-yl)methyl]glycinamid [German] [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-N2-[(4-methoxyphenyl)acetyl]-N2-(3-methylbutyl)-N-[(4-oxo-4H-chromen-3-yl)methyl]glycinamide [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-N2-[2-(4-méthoxyphényl)acétyl]-N2-(3-méthylbutyl)-N-[(4-oxo-4H-chromén-3-yl)méthyl]glycinamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 712.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.2±3.0 kJ/mol
Flash Point: 384.6±32.9 °C
Index of Refraction: 1.584
Molar Refractivity: 153.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.91
ACD/LogD (pH 5.5): 4.65
ACD/BCF (pH 5.5): 2007.18
ACD/KOC (pH 5.5): 8046.16
ACD/LogD (pH 7.4): 4.65
ACD/BCF (pH 7.4): 2007.19
ACD/KOC (pH 7.4): 8046.16
Polar Surface Area: 76 Å2
Polarizability: 61.0±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 460.0±3.0 cm3

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