ChemSpider 2D Image | 4-(4-Fluorophenyl)-6,8-dihydropyrazolo[3,4-e][1,4]diazepin-7(1H)-one | C12H9FN4O

4-(4-Fluorophenyl)-6,8-dihydropyrazolo[3,4-e][1,4]diazepin-7(1H)-one

  • Molecular FormulaC12H9FN4O
  • Average mass244.225 Da
  • Monoisotopic mass244.076035 Da
  • ChemSpider ID24808342

More details:

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

4-(4-Fluorophenyl)-6,8-dihydropyrazolo[3,4-e][1,4]diazepin-7(1H)-one [ACD/IUPAC Name]
4-(4-Fluorophényl)-6,8-dihydropyrazolo[3,4-e][1,4]diazépin-7(1H)-one [French] [ACD/IUPAC Name]
4-(4-Fluorphenyl)-6,8-dihydropyrazolo[3,4-e][1,4]diazepin-7(1H)-on [German] [ACD/IUPAC Name]
Pyrazolo[3,4-e][1,4]diazepin-7(1H)-one, 4-(4-fluorophenyl)-6,8-dihydro- [ACD/Index Name]
Kinome_3603

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

Density: 1.5±0.1 g/cm3
Boiling Point: 501.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.0±3.0 kJ/mol
Flash Point: 256.8±30.1 °C
Index of Refraction: 1.723
Molar Refractivity: 63.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.88
ACD/LogD (pH 5.5): 1.16
ACD/BCF (pH 5.5): 4.46
ACD/KOC (pH 5.5): 101.50
ACD/LogD (pH 7.4): 1.16
ACD/BCF (pH 7.4): 4.46
ACD/KOC (pH 7.4): 101.49
Polar Surface Area: 70 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 57.2±7.0 dyne/cm
Molar Volume: 159.3±7.0 cm3

Click to predict properties on the Chemicalize site


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