ChemSpider 2D Image | Methyl N-({1-[(4-nitrophenyl)amino]-1-oxo-3-phenyl-2-propanyl}carbamoyl)norleucyllysinate | C29H40N6O7

Methyl N-({1-[(4-nitrophenyl)amino]-1-oxo-3-phenyl-2-propanyl}carbamoyl)norleucyllysinate

  • Molecular FormulaC29H40N6O7
  • Average mass584.664 Da
  • Monoisotopic mass584.295837 Da
  • ChemSpider ID23354909

More details:

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

Lysine, N-[[[2-[(4-nitrophenyl)amino]-2-oxo-1-(phenylmethyl)ethyl]amino]carbonyl]norleucyl-, methyl ester [ACD/Index Name]
Methyl N-({1-[(4-nitrophenyl)amino]-1-oxo-3-phenyl-2-propanyl}carbamoyl)norleucyllysinate [ACD/IUPAC Name]
Methyl N-({1-[(4-nitrophenyl)amino]-1-oxo-3-phenylpropan-2-yl}carbamoyl)norleucyllysinate
MethylN-({1-[(4-nitrophenyl)amino]-1-oxo-3-phenyl-2-propanyl}carbamoyl)norleucyllysinat [German] [ACD/IUPAC Name]
N-({1-[(4-Nitrophényl)amino]-1-oxo-3-phényl-2-propanyl}carbamoyl)norleucyllysinate de méthyle [French] [ACD/IUPAC Name]
L-796,778

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

Density: 1.2±0.1 g/cm3
Boiling Point: 868.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 126.3±3.0 kJ/mol
Flash Point: 479.2±34.3 °C
Index of Refraction: 1.581
Molar Refractivity: 157.1±0.3 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: 3.93
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.67
Polar Surface Area: 197 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 471.6±3.0 cm3

Click to predict properties on the Chemicalize site


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