ChemSpider 2D Image | 3-{3-[3,5-Bis(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}-N'-(2-pyrazinyl)acrylohydrazide | C17H11F6N7O

3-{3-[3,5-Bis(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}-N'-(2-pyrazinyl)acrylohydrazide

  • Molecular FormulaC17H11F6N7O
  • Average mass443.306 Da
  • Monoisotopic mass443.092926 Da
  • ChemSpider ID57831908

More details:

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

1421923-86-5 [RN]
2-Propenoic acid, 3-[3-[3,5-bis(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl]-, 2-(2-pyrazinyl)hydrazide [ACD/Index Name]
3-{3-[3,5-Bis(trifluormethyl)phenyl]-1H-1,2,4-triazol-1-yl}-N'-(2-pyrazinyl)acrylohydrazid [German] [ACD/IUPAC Name]
3-{3-[3,5-Bis(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}-N'-(2-pyrazinyl)acrylohydrazide [ACD/IUPAC Name]
3-{3-[3,5-Bis(trifluorométhyl)phényl]-1H-1,2,4-triazol-1-yl}-N'-(2-pyrazinyl)acrylohydrazide [French] [ACD/IUPAC Name]
1393477-72-9 [RN]
selinexor [INN] [USAN]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.594
Molar Refractivity: 96.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.62
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 93.78
ACD/KOC (pH 5.5): 897.73
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 93.81
ACD/KOC (pH 7.4): 898.11
Polar Surface Area: 98 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 44.4±7.0 dyne/cm
Molar Volume: 285.0±7.0 cm3

Click to predict properties on the Chemicalize site


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