ChemSpider 2D Image | 5-(2,5-Dimethoxyphenyl)-N-{3-[(4-fluorobenzyl)amino]-3-oxopropyl}-N-isobutyl-1,2-oxazole-3-carboxamide | C26H30FN3O5

5-(2,5-Dimethoxyphenyl)-N-{3-[(4-fluorobenzyl)amino]-3-oxopropyl}-N-isobutyl-1,2-oxazole-3-carboxamide

  • Molecular FormulaC26H30FN3O5
  • Average mass483.532 Da
  • Monoisotopic mass483.216949 Da
  • ChemSpider ID22685897

More details:






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

3-Isoxazolecarboxamide, 5-(2,5-dimethoxyphenyl)-N-[3-[[(4-fluorophenyl)methyl]amino]-3-oxopropyl]-N-(2-methylpropyl)- [ACD/Index Name]
5-(2,5-Dimethoxyphenyl)-N-{3-[(4-fluorbenzyl)amino]-3-oxopropyl}-N-isobutyl-1,2-oxazol-3-carboxamid [German] [ACD/IUPAC Name]
5-(2,5-Dimethoxyphenyl)-N-{3-[(4-fluorobenzyl)amino]-3-oxopropyl}-N-isobutyl-1,2-oxazole-3-carboxamide [ACD/IUPAC Name]
5-(2,5-Diméthoxyphényl)-N-{3-[(4-fluorobenzyl)amino]-3-oxopropyl}-N-isobutyl-1,2-oxazole-3-carboxamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 704.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 379.7±32.9 °C
Index of Refraction: 1.550
Molar Refractivity: 128.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 159.24
ACD/KOC (pH 5.5): 1311.69
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 159.24
ACD/KOC (pH 7.4): 1311.69
Polar Surface Area: 94 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 404.3±3.0 cm3

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