ChemSpider 2D Image | N-[(Benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-dimethyl-4-heptanyl]-L-leucinamide | C29H49N3O6

N-[(Benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-dimethyl-4-heptanyl]-L-leucinamide

  • Molecular FormulaC29H49N3O6
  • Average mass535.716 Da
  • Monoisotopic mass535.362122 Da
  • ChemSpider ID35034869

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

L-Leucinamide, N-[(phenylmethoxy)carbonyl]-L-leucyl-N-[(1S,2S,3R)-2,4-dihydroxy-3-methyl-1-(2-methylpropyl)butyl]- [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-dimethyl-4-heptanyl]-L-leucinamid [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-dimethyl-4-heptanyl]-L-leucinamide [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-diméthyl-4-heptanyl]-L-leucinamide [French] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-Leucyl-N-[(2r,3s,4s)-1,3-Dihydroxy-2,6-Dimethylheptan-4-Yl]-L-Leucinamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 769.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.5±3.0 kJ/mol
Flash Point: 418.9±32.9 °C
Index of Refraction: 1.516
Molar Refractivity: 148.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 3
ACD/LogP: 5.08
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 790.66
ACD/KOC (pH 5.5): 4130.31
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 790.37
ACD/KOC (pH 7.4): 4128.76
Polar Surface Area: 137 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 491.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement