ChemSpider 2D Image | 5-{4-[4-(5-Cyano-1H-indol-3-yl)butyl](2,2,6,6-~2~H_4_)-1-piperazinyl}-1-benzofuran-2-carboxamide | C26H23D4N5O2

5-{4-[4-(5-Cyano-1H-indol-3-yl)butyl](2,2,6,6-2H4)-1-piperazinyl}-1-benzofuran-2-carboxamide

  • Molecular FormulaC26H23D4N5O2
  • Average mass445.549 Da
  • Monoisotopic mass445.241577 Da
  • ChemSpider ID107433571

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Benzofurancarboxamide, 5-[4-[4-(5-cyano-1H-indol-3-yl)butyl]-1-piperazinyl-2,2,6,6-d4]- [ACD/Index Name]
5-{4-[4-(5-Cyan-1H-indol-3-yl)butyl](2,2,6,6-2H4)-1-piperazinyl}-1-benzofuran-2-carboxamid [German] [ACD/IUPAC Name]
5-{4-[4-(5-Cyano-1H-indol-3-yl)butyl](2,2,6,6-2H4)-1-piperazinyl}-1-benzofuran-2-carboxamide [ACD/IUPAC Name]
5-{4-[4-(5-Cyano-1H-indol-3-yl)butyl](2,2,6,6-2H4)-1-pipérazinyl}-1-benzofurane-2-carboxamide [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: 745.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.6±3.0 kJ/mol
Flash Point: 404.4±32.9 °C
Index of Refraction: 1.711
Molar Refractivity: 128.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 102 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 75.3±5.0 dyne/cm
Molar Volume: 328.8±5.0 cm3

Click to predict properties on the Chemicalize site


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