ChemSpider 2D Image | 5-Fluoro-N-methyl-2-[(2E)-2-{[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylene}hydrazino]-4-pyrimidinamine | C28H22FN7O2

5-Fluoro-N-methyl-2-[(2E)-2-{[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylene}hydrazino]-4-pyrimidinamine

  • Molecular FormulaC28H22FN7O2
  • Average mass507.518 Da
  • Monoisotopic mass507.181915 Da
  • ChemSpider ID62523240

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrrole-3-carboxaldehyde, 1-(4-nitrophenyl)-2,5-diphenyl-, 2-[5-fluoro-4-(methylamino)-2-pyrimidinyl]hydrazone [ACD/Index Name]
5-Fluor-N-methyl-2-[(2E)-2-{[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylen}hydrazino]-4-pyrimidinamin [German] [ACD/IUPAC Name]
5-Fluoro-N-methyl-2-[(2E)-2-{[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylene}hydrazino]-4-pyrimidinamine [ACD/IUPAC Name]
5-Fluoro-N-méthyl-2-[(2E)-2-{[1-(4-nitrophényl)-2,5-diphényl-1H-pyrrol-3-yl]méthylène}hydrazino]-4-pyrimidinamine [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: 762.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.1±3.0 kJ/mol
Flash Point: 415.2±35.7 °C
Index of Refraction: 1.675
Molar Refractivity: 143.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 5.43
ACD/BCF (pH 5.5): 7313.41
ACD/KOC (pH 5.5): 18652.57
ACD/LogD (pH 7.4): 5.55
ACD/BCF (pH 7.4): 9808.19
ACD/KOC (pH 7.4): 25015.41
Polar Surface Area: 113 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 53.5±7.0 dyne/cm
Molar Volume: 381.8±7.0 cm3

Click to predict properties on the Chemicalize site


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