ChemSpider 2D Image | 1-[5-(Benzoylamino)-2-methyl-4-oxo-6-phenylhexanoyl]-L-proline | C25H28N2O5

1-[5-(Benzoylamino)-2-methyl-4-oxo-6-phenylhexanoyl]-L-proline

  • Molecular FormulaC25H28N2O5
  • Average mass436.500 Da
  • Monoisotopic mass436.199829 Da
  • ChemSpider ID57464631

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

1-[5-(Benzoylamino)-2-methyl-4-oxo-6-phenylhexanoyl]-L-prolin [German] [ACD/IUPAC Name]
1-[5-(Benzoylamino)-2-methyl-4-oxo-6-phenylhexanoyl]-L-proline [ACD/IUPAC Name]
1-[5-(Benzoylamino)-2-méthyl-4-oxo-6-phénylhexanoyl]-L-proline [French] [ACD/IUPAC Name]
L-Proline, 1-[5-(benzoylamino)-2-methyl-1,4-dioxo-6-phenylhexyl]- [ACD/Index Name]
5-benzamido-2-methyl-4-oxo-6-phenylhexanoylproline

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

Density: 1.3±0.1 g/cm3
Boiling Point: 732.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 112.2±3.0 kJ/mol
Flash Point: 396.7±32.9 °C
Index of Refraction: 1.592
Molar Refractivity: 118.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.85
ACD/LogD (pH 7.4): -1.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 349.1±3.0 cm3

Click to predict properties on the Chemicalize site


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