ChemSpider 2D Image | TCMDC-125175 | C32H36N4O3

TCMDC-125175

  • Molecular FormulaC32H36N4O3
  • Average mass524.653 Da
  • Monoisotopic mass524.278748 Da
  • ChemSpider ID2730225

More details:

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

1,3,8-Triazaspiro[4.5]decane-3-acetamide, 8-([1,1'-biphenyl]-4-ylcarbonyl)-N-(1-methylpropyl)-4-oxo-1-phenyl- [ACD/Index Name]
2-[8-(4-Biphenylylcarbonyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-sec-butylacetamid [German] [ACD/IUPAC Name]
2-[8-(4-Biphenylylcarbonyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-sec-butylacetamide [ACD/IUPAC Name]
2-[8-(4-Biphénylylcarbonyl)-4-oxo-1-phényl-1,3,8-triazaspiro[4.5]déc-3-yl]-N-sec-butylacétamide [French] [ACD/IUPAC Name]
2-[8-(Biphenyl-4-ylcarbonyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-sec-butylacetamide
TCMDC-125175
  • Miscellaneous

    • Bio Activity:

      XC50_3D7 (uM) (Plasmodium Falciparum, Malaria): 0.127616945 GlaxoSmithKline Malaria Set

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

Density: 1.3±0.1 g/cm3
Boiling Point: 794.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.6±3.0 kJ/mol
Flash Point: 434.4±32.9 °C
Index of Refraction: 1.653
Molar Refractivity: 152.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 450.10
ACD/KOC (pH 5.5): 2759.57
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 450.10
ACD/KOC (pH 7.4): 2759.59
Polar Surface Area: 73 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 61.9±5.0 dyne/cm
Molar Volume: 416.7±5.0 cm3

Click to predict properties on the Chemicalize site


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