ChemSpider 2D Image | N-{[(4-Ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}norleucyl-L-methionine | C25H34N2O7S

N-{[(4-Ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}norleucyl-L-methionine

  • Molecular FormulaC25H34N2O7S
  • Average mass506.612 Da
  • Monoisotopic mass506.208679 Da
  • ChemSpider ID21830722

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

L-Methionine, N-[2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl]norleucyl- [ACD/Index Name]
N-{[(4-Ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}norleucyl-L-methionin [German] [ACD/IUPAC Name]
N-{[(4-Ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}norleucyl-L-methionine [ACD/IUPAC Name]
N-{2-[(4-Éthyl-8-méthyl-2-oxo-2H-chromén-7-yl)oxy]acétyl}norleucyl-L-méthionine [French] [ACD/IUPAC Name]
(2S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)hexanamido)-4-(methylthio)butanoic acid
(2S)-2-{[2-({2-[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)hexanoyl]amino}-4-(methylsulfanyl)butanoic acid
(2S)-2-{2-[2-(4-ethyl-8-methyl-2-oxochromen-7-yloxy)acetylamino]hexanoylamino}-4-methylthiobutanoic acid
2-{2-[2-(4-Ethyl-8-methyl-2-oxo-2H-chromen-7-yloxy)-acetylamino]-hexanoylamino}-4-methylsulfanyl-butyric acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 815.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.3±3.0 kJ/mol
Flash Point: 447.0±34.3 °C
Index of Refraction: 1.558
Molar Refractivity: 132.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 5.05
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 1.08
ACD/KOC (pH 5.5): 7.22
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 156 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 412.2±3.0 cm3

Click to predict properties on the Chemicalize site


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