ChemSpider 2D Image | 2-(2-Butoxyphenyl)-5-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-one | C27H25ClN4O3

2-(2-Butoxyphenyl)-5-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-one

  • Molecular FormulaC27H25ClN4O3
  • Average mass488.965 Da
  • Monoisotopic mass488.161530 Da
  • ChemSpider ID29053407

More details:

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

2-(2-Butoxyphenyl)-5-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-one [ACD/IUPAC Name]
2-(2-Butoxyphényl)-5-{[2-(3-chlorophényl)-5-méthyl-1,3-oxazol-4-yl]méthyl}pyrazolo[1,5-a]pyrazin-4(5H)-one [French] [ACD/IUPAC Name]
2-(2-Butoxyphenyl)-5-{[2-(3-chlorphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-on [German] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrazin-4(5H)-one, 2-(2-butoxyphenyl)-5-[[2-(3-chlorophenyl)-5-methyl-4-oxazolyl]methyl]- [ACD/Index Name]
1358645-32-5 [RN]
2-(2-butoxyphenyl)-5-((2-(3-chlorophenyl)-5-methyloxazol-4-yl)methyl)pyrazolo[1,5-a]pyrazin-4(5H)-one
2-(2-butoxyphenyl)-5-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-4H,5H-pyrazolo[1,5-a]pyrazin-4-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 616.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.5±3.0 kJ/mol
Flash Point: 326.8±34.3 °C
Index of Refraction: 1.650
Molar Refractivity: 136.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.90
ACD/LogD (pH 5.5): 5.22
ACD/BCF (pH 5.5): 5483.56
ACD/KOC (pH 5.5): 16520.11
ACD/LogD (pH 7.4): 5.22
ACD/BCF (pH 7.4): 5483.59
ACD/KOC (pH 7.4): 16520.18
Polar Surface Area: 73 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 373.0±7.0 cm3

Click to predict properties on the Chemicalize site


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