Found 1 result

Search term: QNARFGGMEFFQAS-IRXDYDNUSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(Sulfanylacetyl)-L-leucyl-N-methyl-L-tryptophanamide | C20H28N4O3S

N-(Sulfanylacetyl)-L-leucyl-N-methyl-L-tryptophanamide

  • Molecular FormulaC20H28N4O3S
  • Average mass404.526 Da
  • Monoisotopic mass404.188202 Da
  • ChemSpider ID24685157

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Tryptophanamide, N-(2-mercaptoacetyl)-L-leucyl-N-methyl- [ACD/Index Name]
N-(2-Sulfanylacétyl)-L-leucyl-N-méthyl-L-tryptophaneamide [French] [ACD/IUPAC Name]
N-(Sulfanylacetyl)-L-leucyl-N-methyl-L-tryptophanamid [German] [ACD/IUPAC Name]
N-(Sulfanylacetyl)-L-leucyl-N-methyl-L-tryptophanamide [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL426028/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 787.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.5±3.0 kJ/mol
Flash Point: 429.8±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 113.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 24.16
ACD/KOC (pH 5.5): 339.67
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 20.99
ACD/KOC (pH 7.4): 295.15
Polar Surface Area: 142 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 332.7±3.0 cm3

Click to predict properties on the Chemicalize site


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