ChemSpider 2D Image | 1-(2-{4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl}ethyl)(4,5,6,7-~2~H_4_)-1,3-dihydro-2H-benzimidazol-2-one | C20H17D4F3N4O

1-(2-{4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl}ethyl)(4,5,6,7-2H4)-1,3-dihydro-2H-benzimidazol-2-one

  • Molecular FormulaC20H17D4F3N4O
  • Average mass394.427 Da
  • Monoisotopic mass394.191864 Da
  • ChemSpider ID103835526

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(2-{4-[3-(Trifluormethyl)phenyl]-1-piperazinyl}ethyl)(4,5,6,7-2H4)-1,3-dihydro-2H-benzimidazol-2-on [German] [ACD/IUPAC Name]
1-(2-{4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl}ethyl)(4,5,6,7-2H4)-1,3-dihydro-2H-benzimidazol-2-one [ACD/IUPAC Name]
1-(2-{4-[3-(Trifluorométhyl)phényl]-1-pipérazinyl}éthyl)(4,5,6,7-2H4)-1,3-dihydro-2H-benzimidazol-2-one [French] [ACD/IUPAC Name]
2H-Benzimidazol-2-one-4,5,6,7-d4, 1,3-dihydro-1-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]- [ACD/Index Name]
2122830-90-2 [RN]
2122830-91-3 [RN]
4,5,6,7-tetradeuterio-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-benzimidazol-2-one
Flibanserin D4
Flibanserin-d4

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.567
Molar Refractivity: 98.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.07
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 21.89
ACD/KOC (pH 5.5): 155.44
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 234.91
ACD/KOC (pH 7.4): 1667.93
Polar Surface Area: 39 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 302.0±3.0 cm3

Click to predict properties on the Chemicalize site


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