ChemSpider 2D Image | Ethyl 3-({3-[2-(3-fluorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanoyl}amino)-3-(4-methylphenyl)propanoate | C29H31FN4O3

Ethyl 3-({3-[2-(3-fluorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanoyl}amino)-3-(4-methylphenyl)propanoate

  • Molecular FormulaC29H31FN4O3
  • Average mass502.580 Da
  • Monoisotopic mass502.238007 Da
  • ChemSpider ID21904054

More details:

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

3-({3-[2-(3-Fluorophényl)-5,7-diméthylpyrazolo[1,5-a]pyrimidin-6-yl]propanoyl}amino)-3-(4-méthylphényl)propanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-[[3-[2-(3-fluorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-1-oxopropyl]amino]-4-methyl-, ethyl ester [ACD/Index Name]
Ethyl 3-({3-[2-(3-fluorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanoyl}amino)-3-(4-methylphenyl)propanoate [ACD/IUPAC Name]
Ethyl-3-({3-[2-(3-fluorphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanoyl}amino)-3-(4-methylphenyl)propanoat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 141.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1888.53
ACD/KOC (pH 5.5): 7702.68
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1888.61
ACD/KOC (pH 7.4): 7703.01
Polar Surface Area: 86 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 42.8±7.0 dyne/cm
Molar Volume: 410.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement