Found 61 results

Search term: MF = 'C_{35}H_{52}N_{4}O_{6}'
ChemSpider 2D Image | TCMDC-131866 | C35H52N4O6

TCMDC-131866

  • Molecular FormulaC35H52N4O6
  • Average mass624.811 Da
  • Monoisotopic mass624.388672 Da
  • ChemSpider ID24571822

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(Méthylènebis{4,1-phénylèneimino[(2S)-4-méthyl-1-oxo-1,2-pentanediyl]})biscarbamate de bis(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl) (methylenebis{4,1-phenyleneimino[(2S)-4-methyl-1-oxo-1,2-pentanediyl]})biscarbamate [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl)-(methylenbis{4,1-phenylenimino[(2S)-4-methyl-1-oxo-1,2-pentandiyl]})biscarbamat [German] [ACD/IUPAC Name]
Carbamic acid, N,N'-[methylenebis[4,1-phenyleneimino[(1S)-1-(2-methylpropyl)-2-oxo-2,1-ethanediyl]]]bis-, bis(1,1-dimethylethyl) ester [ACD/Index Name]
Di-tert-butyl (methylenebis{4,1-phenyleneimino[(2S)-4-methyl-1-oxopentane-1,2-diyl]})biscarbamate (non-preferred name)
TCMDC-131866
  • Miscellaneous

    • Bio Activity:

      XC50_3D7 (uM) (Plasmodium Falciparum, Malaria): 0.760651833 GlaxoSmithKline Malaria Set

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

Density: 1.1±0.1 g/cm3
Boiling Point: 790.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.0±3.0 kJ/mol
Flash Point: 432.1±32.9 °C
Index of Refraction: 1.551
Molar Refractivity: 178.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 7.53
ACD/LogD (pH 5.5): 6.71
ACD/BCF (pH 5.5): 73947.37
ACD/KOC (pH 5.5): 106353.66
ACD/LogD (pH 7.4): 6.71
ACD/BCF (pH 7.4): 73911.09
ACD/KOC (pH 7.4): 106301.48
Polar Surface Area: 135 Å2
Polarizability: 70.6±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 558.3±3.0 cm3

Click to predict properties on the Chemicalize site


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