ChemSpider 2D Image | 2-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]methyl}-N-(3-fluoro-4-methylphenyl)-1,3-oxazole-4-carboxamide | C21H29FN4O4

2-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]methyl}-N-(3-fluoro-4-methylphenyl)-1,3-oxazole-4-carboxamide

  • Molecular FormulaC21H29FN4O4
  • Average mass420.478 Da
  • Monoisotopic mass420.217285 Da
  • ChemSpider ID22781434

More details:

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

2-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]methyl}-N-(3-fluor-4-methylphenyl)-1,3-oxazol-4-carboxamid [German] [ACD/IUPAC Name]
2-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]methyl}-N-(3-fluoro-4-methylphenyl)-1,3-oxazole-4-carboxamide [ACD/IUPAC Name]
2-{[4-(3-Éthoxy-2-hydroxypropyl)-1-pipérazinyl]méthyl}-N-(3-fluoro-4-méthylphényl)-1,3-oxazole-4-carboxamide [French] [ACD/IUPAC Name]
4-Oxazolecarboxamide, 2-[[4-(3-ethoxy-2-hydroxypropyl)-1-piperazinyl]methyl]-N-(3-fluoro-4-methylphenyl)- [ACD/Index 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: 508.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 261.0±30.1 °C
Index of Refraction: 1.580
Molar Refractivity: 111.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.39
ACD/LogD (pH 7.4): 1.30
ACD/BCF (pH 7.4): 5.64
ACD/KOC (pH 7.4): 116.75
Polar Surface Area: 91 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 333.6±3.0 cm3

Click to predict properties on the Chemicalize site


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