ChemSpider 2D Image | 1H-Benzotriazol-5-yl{4-[bis(4-fluorophenyl)methyl]-1-piperazinyl}methanone | C24H21F2N5O

1H-Benzotriazol-5-yl{4-[bis(4-fluorophenyl)methyl]-1-piperazinyl}methanone

  • Molecular FormulaC24H21F2N5O
  • Average mass433.453 Da
  • Monoisotopic mass433.171417 Da
  • ChemSpider ID22083654

More details:

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

1H-Benzotriazol-5-yl{4-[bis(4-fluorophenyl)methyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
1H-Benzotriazol-5-yl{4-[bis(4-fluorophényl)méthyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
1H-Benzotriazol-5-yl{4-[bis(4-fluorphenyl)methyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
Methanone, 1H-1,2,3-benzotriazol-5-yl[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 632.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.1±31.5 °C
Index of Refraction: 1.667
Molar Refractivity: 117.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 81.71
ACD/KOC (pH 5.5): 711.72
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 108.47
ACD/KOC (pH 7.4): 944.86
Polar Surface Area: 65 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 315.0±3.0 cm3

Click to predict properties on the Chemicalize site


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