ChemSpider 2D Image | N-[(Benzyloxy)carbonyl]-L-valyl-N-[(2E,4S)-1-ethoxy-6-methyl-1-oxo-2-hepten-4-yl]-L-serinamide | C26H39N3O7

N-[(Benzyloxy)carbonyl]-L-valyl-N-[(2E,4S)-1-ethoxy-6-methyl-1-oxo-2-hepten-4-yl]-L-serinamide

  • Molecular FormulaC26H39N3O7
  • Average mass505.604 Da
  • Monoisotopic mass505.278809 Da
  • ChemSpider ID9561502

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Serinamide, N-[(phenylmethoxy)carbonyl]-L-valyl-N-[(1S,2E)-4-ethoxy-1-(2-methylpropyl)-4-oxo-2-buten-1-yl]- [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-L-valyl-N-[(2E,4S)-1-ethoxy-6-methyl-1-oxo-2-hepten-4-yl]-L-serinamid [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-valyl-N-[(2E,4S)-1-ethoxy-6-methyl-1-oxo-2-hepten-4-yl]-L-serinamide [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-valyl-N-[(2E,4S)-1-éthoxy-6-méthyl-1-oxo-2-heptén-4-yl]-L-sérinamide [French] [ACD/IUPAC Name]
N-[(benzyloxy)carbonyl]-L-valyl-N-[(2E,4S)-1-ethoxy-6-methyl-1-oxohept-2-en-4-yl]-L-serinamide
(S)-4-[(S)-2-((S)-2-Benzyloxycarbonylamino-3-methyl-butyrylamino)-3-hydroxy-propionylamino]-6-methyl-hept-2-enoic acid ethyl ester

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

Density: 1.1±0.1 g/cm3
Boiling Point: 748.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.5±3.0 kJ/mol
Flash Point: 406.3±32.9 °C
Index of Refraction: 1.526
Molar Refractivity: 135.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 4.60
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 142.19
ACD/KOC (pH 5.5): 1209.56
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 142.12
ACD/KOC (pH 7.4): 1208.94
Polar Surface Area: 143 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 440.0±3.0 cm3

Click to predict properties on the Chemicalize site


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