ChemSpider 2D Image | N-[2-(2-Amino-1H-imidazol-5-yl)ethyl]-O-(3-aminopropyl)-3,5-dibromo-Nalpha-oxotyrosinamide | C17H22Br2N6O3

N-[2-(2-Amino-1H-imidazol-5-yl)ethyl]-O-(3-aminopropyl)-3,5-dibromo-Nα-oxotyrosinamide

  • Molecular FormulaC17H22Br2N6O3
  • Average mass518.203 Da
  • Monoisotopic mass516.012024 Da
  • ChemSpider ID34974248

More details:

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

Benzenepropanamide, N-[2-(2-amino-1H-imidazol-5-yl)ethyl]-4-(3-aminopropoxy)-3,5-dibromo-α-nitroso- [ACD/Index Name]
N-[2-(2-Amino-1H-imidazol-5-yl)ethyl]-O-(3-aminopropyl)-3,5-dibrom-Nα-oxotyrosinamid [German] [ACD/IUPAC Name]
N-[2-(2-Amino-1H-imidazol-5-yl)ethyl]-O-(3-aminopropyl)-3,5-dibromo-Nα-oxotyrosinamide [ACD/IUPAC Name]
N-[2-(2-Amino-1H-imidazol-5-yl)éthyl]-O-(3-aminopropyl)-3,5-dibromo-Nα-oxotyrosinamide [French] [ACD/IUPAC Name]
CHEMBL83995

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.691
Molar Refractivity: 110.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 1.19
ACD/LogD (pH 5.5): -2.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 148 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 63.5±7.0 dyne/cm
Molar Volume: 287.7±7.0 cm3

Click to predict properties on the Chemicalize site


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