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Search term: DATA_SOURCE in ('Paul Baures')
ChemSpider 2D Image | Benzyl N-[(4-{[5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentyl]carbamoyl}-1H-imidazol-5-yl)carbonyl]glycinate | C24H33N5O6

Benzyl N-[(4-{[5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentyl]carbamoyl}-1H-imidazol-5-yl)carbonyl]glycinate

  • Molecular FormulaC24H33N5O6
  • Average mass487.549 Da
  • Monoisotopic mass487.243073 Da
  • ChemSpider ID21447253

More details:

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

Benzyl N-[(4-{[5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentyl]carbamoyl}-1H-imidazol-5-yl)carbonyl]glycinate [ACD/IUPAC Name]
Benzyl-N-[(4-{[5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentyl]carbamoyl}-1H-imidazol-5-yl)carbonyl]glycinat [German] [ACD/IUPAC Name]
Glycine, N-[[5-[[[5-[[(1,1-dimethylethoxy)carbonyl]amino]pentyl]amino]carbonyl]-1H-imidazol-4-yl]carbonyl]-, phenylmethyl ester [ACD/Index Name]
N-[(4-{[5-({[(2-Méthyl-2-propanyl)oxy]carbonyl}amino)pentyl]carbamoyl}-1H-imidazol-5-yl)carbonyl]glycinate de benzyle [French] [ACD/IUPAC Name]
AE01_PA07

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

Density: 1.2±0.1 g/cm3
Boiling Point: 798.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.1±3.0 kJ/mol
Flash Point: 436.7±32.9 °C
Index of Refraction: 1.556
Molar Refractivity: 128.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 13.09
ACD/KOC (pH 5.5): 219.13
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 12.78
ACD/KOC (pH 7.4): 213.95
Polar Surface Area: 152 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 399.8±3.0 cm3

Click to predict properties on the Chemicalize site


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