ChemSpider 2D Image | 6-(Methyl{1-[3-(3-pyridinyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-3-azetidinyl}amino)nicotinonitrile | C20H17N9

6-(Methyl{1-[3-(3-pyridinyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-3-azetidinyl}amino)nicotinonitrile

  • Molecular FormulaC20H17N9
  • Average mass383.409 Da
  • Monoisotopic mass383.160706 Da
  • ChemSpider ID77448017

More details:

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

3-Pyridinecarbonitrile, 6-[methyl[1-[3-(3-pyridinyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]-3-azetidinyl]amino]- [ACD/Index Name]
6-(Methyl{1-[3-(3-pyridinyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-3-azetidinyl}amino)nicotinonitril [German] [ACD/IUPAC Name]
6-(Methyl{1-[3-(3-pyridinyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-3-azetidinyl}amino)nicotinonitrile [ACD/IUPAC Name]
6-(Méthyl{1-[3-(3-pyridinyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-3-azétidinyl}amino)nicotinonitrile [French] [ACD/IUPAC Name]
2380068-03-9 [RN]
6-[methyl({1-[3-(pyridin-3-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]azetidin-3-yl})amino]pyridine-3-carbonitrile

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: 1.782
Molar Refractivity: 110.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.61
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 5.96
ACD/KOC (pH 5.5): 124.46
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 6.05
ACD/KOC (pH 7.4): 126.20
Polar Surface Area: 99 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 66.7±7.0 dyne/cm
Molar Volume: 263.6±7.0 cm3

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