ChemSpider 2D Image | 2-{4-[3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepan-1-yl}quinoxaline | C19H17F3N8

2-{4-[3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepan-1-yl}quinoxaline

  • Molecular FormulaC19H17F3N8
  • Average mass414.387 Da
  • Monoisotopic mass414.152832 Da
  • ChemSpider ID77448003

More details:

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

2-{4-[3-(Trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepan-1-yl}chinoxalin [German] [ACD/IUPAC Name]
2-{4-[3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepan-1-yl}quinoxaline [ACD/IUPAC Name]
2-{4-[3-(Trifluorométhyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazépan-1-yl}quinoxaline [French] [ACD/IUPAC Name]
Quinoxaline, 2-[hexahydro-4-[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]-1H-1,4-diazepin-1-yl]- [ACD/Index Name]
2-{4-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepan-1-yl}quinoxaline
2380010-45-5 [RN]

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: 1.717
Molar Refractivity: 104.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 1.48
ACD/BCF (pH 5.5): 6.32
ACD/KOC (pH 5.5): 100.24
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.57
ACD/KOC (pH 7.4): 247.06
Polar Surface Area: 75 Å2
Polarizability: 41.5±0.5 10-24cm3
Surface Tension: 57.2±7.0 dyne/cm
Molar Volume: 265.7±7.0 cm3

Click to predict properties on the Chemicalize site


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