ChemSpider 2D Image | N-(3-Bromophenyl)-3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]propanamide | C20H20BrN7O

N-(3-Bromophenyl)-3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]propanamide

  • Molecular FormulaC20H20BrN7O
  • Average mass454.323 Da
  • Monoisotopic mass453.091278 Da
  • ChemSpider ID29053722

More details:

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

1H-Pyrazole-4-propanamide, N-(3-bromophenyl)-3,5-dimethyl-1-(3-methyl-1,2,4-triazolo[4,3-b]pyridazin-6-yl)- [ACD/Index Name]
N-(3-Bromophenyl)-3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]propanamide [ACD/IUPAC Name]
N-(3-Bromophényl)-3-[3,5-diméthyl-1-(3-méthyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]propanamide [French] [ACD/IUPAC Name]
N-(3-Bromphenyl)-3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]propanamid [German] [ACD/IUPAC Name]

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: 1.720
Molar Refractivity: 115.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 141.45
ACD/KOC (pH 5.5): 1205.05
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 141.45
ACD/KOC (pH 7.4): 1205.06
Polar Surface Area: 90 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 56.1±7.0 dyne/cm
Molar Volume: 292.7±7.0 cm3

Click to predict properties on the Chemicalize site


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