ChemSpider 2D Image | 1-[(Z)-2-Hydroxy-2-{4-[4-(2-pyrimidinyl)phenyl]-1-piperazinyl}vinyl]-N-(3-phenyl-1H-indazol-5-yl)-3-pyrrolidinecarboxamide | C34H34N8O2

1-[(Z)-2-Hydroxy-2-{4-[4-(2-pyrimidinyl)phenyl]-1-piperazinyl}vinyl]-N-(3-phenyl-1H-indazol-5-yl)-3-pyrrolidinecarboxamide

  • Molecular FormulaC34H34N8O2
  • Average mass586.686 Da
  • Monoisotopic mass586.280457 Da
  • ChemSpider ID95634798

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(Z)-2-Hydroxy-2-{4-[4-(2-pyrimidinyl)phenyl]-1-piperazinyl}vinyl]-N-(3-phenyl-1H-indazol-5-yl)-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
1-[(Z)-2-Hydroxy-2-{4-[4-(2-pyrimidinyl)phenyl]-1-piperazinyl}vinyl]-N-(3-phenyl-1H-indazol-5-yl)-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
1-[(Z)-2-Hydroxy-2-{4-[4-(2-pyrimidinyl)phényl]-1-pipérazinyl}vinyl]-N-(3-phényl-1H-indazol-5-yl)-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxamide, 1-[(Z)-2-hydroxy-2-[4-[4-(2-pyrimidinyl)phenyl]-1-piperazinyl]ethenyl]-N-(3-phenyl-1H-indazol-5-yl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 835.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 127.3±3.0 kJ/mol
Flash Point: 459.1±34.3 °C
Index of Refraction: 1.747
Molar Refractivity: 171.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 2.91
ACD/KOC (pH 5.5): 20.20
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 3.55
ACD/KOC (pH 7.4): 24.67
Polar Surface Area: 114 Å2
Polarizability: 68.1±0.5 10-24cm3
Surface Tension: 80.6±3.0 dyne/cm
Molar Volume: 423.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement