ChemSpider 2D Image | 2-{6-[2-(2,4-Difluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-2-methyl-1-propanol | C21H20F2N6O

2-{6-[2-(2,4-Difluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-2-methyl-1-propanol

  • Molecular FormulaC21H20F2N6O
  • Average mass410.420 Da
  • Monoisotopic mass410.166656 Da
  • ChemSpider ID24808378

More details:

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

1,2,4-Triazolo[4,3-b]pyridazine-3-ethanol, 6-[2-(2,4-difluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-β,β-dimethyl- [ACD/Index Name]
2-{6-[2-(2,4-Difluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-2-methyl-1-propanol [ACD/IUPAC Name]
2-{6-[2-(2,4-Difluorophényl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-2-méthyl-1-propanol [French] [ACD/IUPAC Name]
2-{6-[2-(2,4-Difluorphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-2-methyl-1-propanol [German] [ACD/IUPAC Name]
Kinome_3498

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.710
Molar Refractivity: 107.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 3.07
ACD/BCF (pH 5.5): 126.11
ACD/KOC (pH 5.5): 1108.63
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 126.66
ACD/KOC (pH 7.4): 1113.45
Polar Surface Area: 81 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 53.7±7.0 dyne/cm
Molar Volume: 275.0±7.0 cm3

Click to predict properties on the Chemicalize site


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