ChemSpider 2D Image | N-{4-[5-(4-{[1H-Imidazol-5-yl(imino)methyl]amino}-2-isobutoxyphenyl)-2-furyl]-3-isobutoxyphenyl}-1H-imidazole-4-carboximidamide | C32H36N8O3

N-{4-[5-(4-{[1H-Imidazol-5-yl(imino)methyl]amino}-2-isobutoxyphenyl)-2-furyl]-3-isobutoxyphenyl}-1H-imidazole-4-carboximidamide

  • Molecular FormulaC32H36N8O3
  • Average mass580.680 Da
  • Monoisotopic mass580.291016 Da
  • ChemSpider ID26633535

More details:

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

1H-Imidazole-4-carboximidamide, N,N'-[2,5-furandiylbis[3-(2-methylpropoxy)-4,1-phenylene]]bis- [ACD/Index Name]
N-{4-[5-(4-{[1H-Imidazol-5-yl(imino)methyl]amino}-2-isobutoxyphenyl)-2-furyl]-3-isobutoxyphenyl}-1H-imidazol-4-carboximidamid [German] [ACD/IUPAC Name]
N-{4-[5-(4-{[1H-Imidazol-5-yl(imino)methyl]amino}-2-isobutoxyphenyl)-2-furyl]-3-isobutoxyphenyl}-1H-imidazole-4-carboximidamide [ACD/IUPAC Name]
N-{4-[5-(4-{[1H-Imidazol-5-yl(imino)méthyl]amino}-2-isobutoxyphényl)-2-furyl]-3-isobutoxyphényl}-1H-imidazole-4-carboximidamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 745.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.7±3.0 kJ/mol
Flash Point: 404.9±35.7 °C
Index of Refraction: 1.659
Molar Refractivity: 162.9±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 4
ACD/LogP: 6.46
ACD/LogD (pH 5.5): 5.04
ACD/BCF (pH 5.5): 3566.35
ACD/KOC (pH 5.5): 10716.49
ACD/LogD (pH 7.4): 5.22
ACD/BCF (pH 7.4): 5474.09
ACD/KOC (pH 7.4): 16449.03
Polar Surface Area: 161 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 50.2±7.0 dyne/cm
Molar Volume: 441.9±7.0 cm3

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