ChemSpider 2D Image | 4',6-Diisopropyl-N-{4-[4-(1H-pyrrol-2-ylmethyl)-1-piperazinyl]phenyl}-2-biphenylcarboxamide | C34H40N4O

4',6-Diisopropyl-N-{4-[4-(1H-pyrrol-2-ylmethyl)-1-piperazinyl]phenyl}-2-biphenylcarboxamide

  • Molecular FormulaC34H40N4O
  • Average mass520.708 Da
  • Monoisotopic mass520.320190 Da
  • ChemSpider ID8414899

More details:

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

[1,1'-Biphenyl]-2-carboxamide, 4',6-bis(1-methylethyl)-N-[4-[4-(1H-pyrrol-2-ylmethyl)-1-piperazinyl]phenyl]- [ACD/Index Name]
4',6-Diisopropyl-N-{4-[4-(1H-pyrrol-2-ylmethyl)-1-piperazinyl]phenyl}-2-biphenylcarboxamid [German] [ACD/IUPAC Name]
4',6-Diisopropyl-N-{4-[4-(1H-pyrrol-2-ylmethyl)-1-piperazinyl]phenyl}-2-biphenylcarboxamide [ACD/IUPAC Name]
4',6-Diisopropyl-N-{4-[4-(1H-pyrrol-2-ylméthyl)-1-pipérazinyl]phényl}-2-biphénylcarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 646.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 344.8±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 161.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 1690.64
ACD/KOC (pH 5.5): 2991.87
ACD/LogD (pH 7.4): 6.19
ACD/BCF (pH 7.4): 28141.49
ACD/KOC (pH 7.4): 49801.15
Polar Surface Area: 51 Å2
Polarizability: 63.9±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 453.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement