ChemSpider 2D Image | 5-[8-Amino-1-(2-ethoxy-4-{[4-(trifluoromethyl)-2-pyridinyl]carbamoyl}phenyl)imidazo[1,5-a]pyrazin-3-yl]bicyclo[3.2.2]nonane-1-carboxylic acid | C31H31F3N6O4

5-[8-Amino-1-(2-ethoxy-4-{[4-(trifluoromethyl)-2-pyridinyl]carbamoyl}phenyl)imidazo[1,5-a]pyrazin-3-yl]bicyclo[3.2.2]nonane-1-carboxylic acid

  • Molecular FormulaC31H31F3N6O4
  • Average mass608.611 Da
  • Monoisotopic mass608.235901 Da
  • ChemSpider ID128962459

More details:

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

5-[8-Amino-1-(2-ethoxy-4-{[4-(trifluormethyl)-2-pyridinyl]carbamoyl}phenyl)imidazo[1,5-a]pyrazin-3-yl]bicyclo[3.2.2]nonan-1-carbonsäure [German] [ACD/IUPAC Name]
5-[8-Amino-1-(2-ethoxy-4-{[4-(trifluoromethyl)-2-pyridinyl]carbamoyl}phenyl)imidazo[1,5-a]pyrazin-3-yl]bicyclo[3.2.2]nonane-1-carboxylic acid [ACD/IUPAC Name]
Acide 5-[8-amino-1-(2-éthoxy-4-{[4-(trifluorométhyl)-2-pyridinyl]carbamoyl}phényl)imidazo[1,5-a]pyrazin-3-yl]bicyclo[3.2.2]nonane-1-carboxylique [French] [ACD/IUPAC Name]
Bicyclo[3.2.2]nonane-1-carboxylic acid, 5-[8-amino-1-[2-ethoxy-4-[[[4-(trifluoromethyl)-2-pyridinyl]amino]carbonyl]phenyl]imidazo[1,5-a]pyrazin-3-yl]- [ACD/Index Name]

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: 1.674
Molar Refractivity: 153.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 3.37
ACD/KOC (pH 5.5): 20.23
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.13
Polar Surface Area: 145 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 56.0±7.0 dyne/cm
Molar Volume: 408.1±7.0 cm3

Click to predict properties on the Chemicalize site


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