ChemSpider 2D Image | TCMDC-124630 | C24H27N5

TCMDC-124630

  • Molecular FormulaC24H27N5
  • Average mass385.505 Da
  • Monoisotopic mass385.226654 Da
  • ChemSpider ID22226166

More details:

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

1H-Pyrazole-4-methanamine, N-[3-(1H-imidazol-1-yl)propyl]-3-(3-methylphenyl)-1-(4-methylphenyl)- [ACD/Index Name]
3-(1H-Imidazol-1-yl)-N-{[3-(3-methylphenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}-1-propanamin [German] [ACD/IUPAC Name]
3-(1H-Imidazol-1-yl)-N-{[3-(3-methylphenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}-1-propanamine [ACD/IUPAC Name]
3-(1H-Imidazol-1-yl)-N-{[3-(3-méthylphényl)-1-(4-méthylphényl)-1H-pyrazol-4-yl]méthyl}-1-propanamine [French] [ACD/IUPAC Name]
3-(1H-Imidazol-1-yl)-N-{[3-(3-methylphenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}propan-1-amine
TCMDC-124630
[3-(1H-IMIDAZOL-1-YL)PROPYL]({[3-(3-METHYLPHENYL)-1-(4-METHYLPHENYL)-1H-PYRAZOL-4-YL]METHYL})AMINE
[3-(IMIDAZOL-1-YL)PROPYL]({[3-(3-METHYLPHENYL)-1-(4-METHYLPHENYL)PYRAZOL-4-YL]METHYL})AMINE
  • Miscellaneous

    • Bio Activity:

      XC50_3D7 (uM) (Plasmodium Falciparum, Malaria): 0.772798578 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: 609.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 322.5±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 119.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 57.33
ACD/KOC (pH 7.4): 286.80
Polar Surface Area: 48 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 44.4±7.0 dyne/cm
Molar Volume: 338.7±7.0 cm3

Click to predict properties on the Chemicalize site


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