ChemSpider 2D Image | 1-(Benzyloxy)-3-(isobutyl{[5-(4-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}amino)-2-propanol | C32H39N3O4

1-(Benzyloxy)-3-(isobutyl{[5-(4-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}amino)-2-propanol

  • Molecular FormulaC32H39N3O4
  • Average mass529.670 Da
  • Monoisotopic mass529.294067 Da
  • ChemSpider ID22692773

More details:

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

1-(Benzyloxy)-3-(isobutyl{[5-(4-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}amino)-2-propanol [ACD/IUPAC Name]
1-(Benzyloxy)-3-(isobutyl{[5-(4-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}amino)-2-propanol [German] [ACD/IUPAC Name]
1-(Benzyloxy)-3-(isobutyl{[5-(4-méthoxyphénoxy)-3-méthyl-1-phényl-1H-pyrazol-4-yl]méthyl}amino)-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[[[5-(4-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl](2-methylpropyl)amino]-3-(phenylmethoxy)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 654.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.3±3.0 kJ/mol
Flash Point: 349.7±31.5 °C
Index of Refraction: 1.570
Molar Refractivity: 155.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 4.88
ACD/BCF (pH 5.5): 1477.93
ACD/KOC (pH 5.5): 2790.00
ACD/LogD (pH 7.4): 6.07
ACD/BCF (pH 7.4): 23040.11
ACD/KOC (pH 7.4): 43494.41
Polar Surface Area: 69 Å2
Polarizability: 61.5±0.5 10-24cm3
Surface Tension: 40.5±7.0 dyne/cm
Molar Volume: 472.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement