Found 153 results

Search term: MF = 'C_{25}H_{19}FN_{6}O_{2}'
ChemSpider 2D Image | 1-[5-(4-Fluorophenyl)-1,2,4-triazin-3-yl]-3-methyl-4-[3-(2-propyn-1-yloxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one | C25H19FN6O2

1-[5-(4-Fluorophenyl)-1,2,4-triazin-3-yl]-3-methyl-4-[3-(2-propyn-1-yloxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one

  • Molecular FormulaC25H19FN6O2
  • Average mass454.456 Da
  • Monoisotopic mass454.155365 Da
  • ChemSpider ID28359188

More details:

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

1-[5-(4-Fluorophenyl)-1,2,4-triazin-3-yl]-3-methyl-4-[3-(2-propyn-1-yloxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one [ACD/IUPAC Name]
1-[5-(4-Fluorophényl)-1,2,4-triazin-3-yl]-3-méthyl-4-[3-(2-propyn-1-yloxy)phényl]-1,4,5,7-tétrahydro-6H-pyrazolo[3,4-b]pyridin-6-one [French] [ACD/IUPAC Name]
1-[5-(4-Fluorphenyl)-1,2,4-triazin-3-yl]-3-methyl-4-[3-(2-propin-1-yloxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-on [German] [ACD/IUPAC Name]
6H-Pyrazolo[3,4-b]pyridin-6-one, 1-[5-(4-fluorophenyl)-1,2,4-triazin-3-yl]-1,4,5,7-tetrahydro-3-methyl-4-[3-(2-propyn-1-yloxy)phenyl]- [ACD/Index Name]
1-[5-(4-fluorophenyl)-1,2,4-triazin-3-yl]-3-methyl-4-[3-(prop-2-yn-1-yloxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.685
Molar Refractivity: 126.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 96.51
ACD/KOC (pH 5.5): 916.60
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 96.51
ACD/KOC (pH 7.4): 916.59
Polar Surface Area: 95 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 331.3±7.0 cm3

Click to predict properties on the Chemicalize site


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