ChemSpider 2D Image | N-{3-[4-(4-Phenyl-2-thienyl)phenyl]propanoyl}-L-alpha-glutamyl-L-alpha-glutamine | C29H31N3O7S

N-{3-[4-(4-Phenyl-2-thienyl)phenyl]propanoyl}-L-α-glutamyl-L-α-glutamine

  • Molecular FormulaC29H31N3O7S
  • Average mass565.637 Da
  • Monoisotopic mass565.188293 Da
  • ChemSpider ID25061229
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

L-α-Glutamine, N-[1-oxo-3-[4-(4-phenyl-2-thienyl)phenyl]propyl]-L-α-glutamyl- [ACD/Index Name]
N-{3-[4-(4-Phenyl-2-thienyl)phenyl]propanoyl}-L-α-glutamyl-L-α-glutamin [German] [ACD/IUPAC Name]
N-{3-[4-(4-Phenyl-2-thienyl)phenyl]propanoyl}-L-α-glutamyl-L-α-glutamine [ACD/IUPAC Name]
N-{3-[4-(4-Phényl-2-thiényl)phényl]propanoyl}-L-α-glutamyl-L-α-glutamine [French] [ACD/IUPAC Name]
N-{3-[4-(4-Phenylthiophen-2-Yl)phenyl]propanoyl}-L-α-Glutamyl-L-α-Glutamyl-Amide
EEG

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

Density: 1.3±0.1 g/cm3
Boiling Point: 954.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 145.6±3.0 kJ/mol
Flash Point: 531.1±34.3 °C
Index of Refraction: 1.612
Molar Refractivity: 148.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 0.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.80
ACD/LogD (pH 7.4): -1.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 204 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 60.6±3.0 dyne/cm
Molar Volume: 426.5±3.0 cm3

Click to predict properties on the Chemicalize site






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