ChemSpider 2D Image | 4-{2-[Benzyl(methyl)carbamoyl]-4-(2-furoylamino)phenyl}-N-(3-methylphenyl)-1-piperazinecarboxamide | C32H33N5O4

4-{2-[Benzyl(methyl)carbamoyl]-4-(2-furoylamino)phenyl}-N-(3-methylphenyl)-1-piperazinecarboxamide

  • Molecular FormulaC32H33N5O4
  • Average mass551.635 Da
  • Monoisotopic mass551.253235 Da
  • ChemSpider ID22633719

More details:

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

1-Piperazinecarboxamide, 4-[4-[(2-furanylcarbonyl)amino]-2-[[methyl(phenylmethyl)amino]carbonyl]phenyl]-N-(3-methylphenyl)- [ACD/Index Name]
4-{2-[Benzyl(methyl)carbamoyl]-4-(2-furoylamino)phenyl}-N-(3-methylphenyl)-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-{2-[Benzyl(methyl)carbamoyl]-4-(2-furoylamino)phenyl}-N-(3-methylphenyl)-1-piperazinecarboxamide [ACD/IUPAC Name]
4-{2-[Benzyl(méthyl)carbamoyl]-4-(2-furoylamino)phényl}-N-(3-méthylphényl)-1-pipérazinecarboxamide [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: 753.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.7±3.0 kJ/mol
Flash Point: 409.2±32.9 °C
Index of Refraction: 1.667
Molar Refractivity: 158.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 220.78
ACD/KOC (pH 5.5): 1650.02
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 224.19
ACD/KOC (pH 7.4): 1675.54
Polar Surface Area: 98 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 62.8±3.0 dyne/cm
Molar Volume: 425.3±3.0 cm3

Click to predict properties on the Chemicalize site


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