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Search term: HBGWEOSHQILMON-ZSOGYDGISA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-Methyl-8-{[(3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]amino}-1,7-naphthyridin-2(1H)-one | C17H22N4O

3-Methyl-8-{[(3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]amino}-1,7-naphthyridin-2(1H)-one

  • Molecular FormulaC17H22N4O
  • Average mass298.383 Da
  • Monoisotopic mass298.179352 Da
  • ChemSpider ID58858952

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1,7-Naphthyridin-2(1H)-one, 3-methyl-8-[[(3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]amino]- [ACD/Index Name]
3-Methyl-8-{[(3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]amino}-1,7-naphthyridin-2(1H)-on [German] [ACD/IUPAC Name]
3-Methyl-8-{[(3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]amino}-1,7-naphthyridin-2(1H)-one [ACD/IUPAC Name]
3-Méthyl-8-{[(3-exo)-8-méthyl-8-azabicyclo[3.2.1]oct-3-yl]amino}-1,7-naphtyridin-2(1H)-one [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 521.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.5±3.0 kJ/mol
Flash Point: 269.5±30.1 °C
Index of Refraction: 1.625
Molar Refractivity: 85.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): -0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 57 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 242.8±3.0 cm3

Click to predict properties on the Chemicalize site


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