Found 360 results

Search term: MF = 'C_{25}H_{18}FN_{3}O_{2}'
ChemSpider 2D Image | 4-[3-(3,4-Dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)-1(2H)-isoquinolinone | C25H18FN3O2

4-[3-(3,4-Dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)-1(2H)-isoquinolinone

  • Molecular FormulaC25H18FN3O2
  • Average mass411.428 Da
  • Monoisotopic mass411.138306 Da
  • ChemSpider ID26026411

More details:

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

1(2H)-Isoquinolinone, 4-[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)- [ACD/Index Name]
4-[3-(3,4-Diméthylphényl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophényl)-1(2H)-isoquinoléinone [French] [ACD/IUPAC Name]
4-[3-(3,4-Dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)-1(2H)-isoquinolinone [ACD/IUPAC Name]
4-[3-(3,4-Dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorphenyl)-1(2H)-isochinolinon [German] [ACD/IUPAC Name]
1326888-27-0 [RN]
4-(3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl)-2-(3-fluorophenyl)isoquinolin-1(2H)-one
4-[3-(3,4-Dimethyl-phenyl)-[1,2,4]oxadiazol-5-yl]-2-(3-fluoro-phenyl)-2H-isoquinolin-1-one
4-[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)-1,2-dihydroisoquinolin-1-one
4-[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)isoquinolin-1(2H)-one
4-[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)isoquinolin-1-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: 614.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.2±3.0 kJ/mol
Flash Point: 325.5±34.3 °C
Index of Refraction: 1.639
Molar Refractivity: 113.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.33
ACD/LogD (pH 5.5): 5.32
ACD/BCF (pH 5.5): 6554.47
ACD/KOC (pH 5.5): 18770.20
ACD/LogD (pH 7.4): 5.32
ACD/BCF (pH 7.4): 6554.47
ACD/KOC (pH 7.4): 18770.20
Polar Surface Area: 59 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 314.8±3.0 cm3

Click to predict properties on the Chemicalize site


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