ChemSpider 2D Image | 4-(4-Benzyl-1-phthalazinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide | C32H29N5O2

4-(4-Benzyl-1-phthalazinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide

  • Molecular FormulaC32H29N5O2
  • Average mass515.605 Da
  • Monoisotopic mass515.232117 Da
  • ChemSpider ID9618580

More details:

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

1-Piperazinecarboxamide, N-(4-phenoxyphenyl)-4-[4-(phenylmethyl)-1-phthalazinyl]- [ACD/Index Name]
4-(4-Benzyl-1-phtalazinyl)-N-(4-phénoxyphényl)-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]
4-(4-Benzyl-1-phthalazinyl)-N-(4-phenoxyphenyl)-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-(4-Benzyl-1-phthalazinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide [ACD/IUPAC Name]
4-(4-benzylphthalazin-1-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide
4-(4-Benzyl-phthalazin-1-yl)-piperazine-1-carboxylic acid (4-phenoxy-phenyl)-amide
CHEMBL147837

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

Density: 1.3±0.1 g/cm3
Boiling Point: 791.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.1±3.0 kJ/mol
Flash Point: 432.4±32.9 °C
Index of Refraction: 1.690
Molar Refractivity: 153.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 18.88
ACD/KOC (pH 5.5): 57.37
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 175.15
ACD/KOC (pH 7.4): 532.20
Polar Surface Area: 71 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 63.6±3.0 dyne/cm
Molar Volume: 401.9±3.0 cm3

Click to predict properties on the Chemicalize site


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