ChemSpider 2D Image | 2-(4-{3-[3-({[2-(2,4-Difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl](methyl)amino}methyl)phenoxy]propoxy}phenyl)-N-hydroxyacetamide | C30H33F2N5O5

2-(4-{3-[3-({[2-(2,4-Difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl](methyl)amino}methyl)phenoxy]propoxy}phenyl)-N-hydroxyacetamide

  • Molecular FormulaC30H33F2N5O5
  • Average mass581.610 Da
  • Monoisotopic mass581.244995 Da
  • ChemSpider ID128728544

More details:

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

2-(4-{3-[3-({[2-(2,4-Difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl](methyl)amino}methyl)phenoxy]propoxy}phenyl)-N-hydroxyacetamide [ACD/IUPAC Name]
2-(4-{3-[3-({[2-(2,4-Difluorophényl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl](méthyl)amino}méthyl)phénoxy]propoxy}phényl)-N-hydroxyacétamide [French] [ACD/IUPAC Name]
2-(4-{3-[3-({[2-(2,4-Difluorphenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl](methyl)amino}methyl)phenoxy]propoxy}phenyl)-N-hydroxyacetamid [German] [ACD/IUPAC Name]
Benzeneacetamide, 4-[3-[3-[[[2-(2,4-difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl]methylamino]methyl]phenoxy]propoxy]-N-hydroxy- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.594
Molar Refractivity: 153.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 1.28
ACD/KOC (pH 5.5): 11.16
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 53.85
ACD/KOC (pH 7.4): 470.52
Polar Surface Area: 122 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 451.4±7.0 cm3

Click to predict properties on the Chemicalize site


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