ChemSpider 2D Image | 7-[(2S,3Z)-2-(Aminomethyl)-3-(ethoxyimino)-1-azetidinyl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid | C18H19F2N5O4

7-[(2S,3Z)-2-(Aminomethyl)-3-(ethoxyimino)-1-azetidinyl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid

  • Molecular FormulaC18H19F2N5O4
  • Average mass407.371 Da
  • Monoisotopic mass407.140503 Da
  • ChemSpider ID58116237

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1,8-Naphthyridine-3-carboxylic acid, 7-[(2S,3Z)-2-(aminomethyl)-3-(ethoxyimino)-1-azetidinyl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-1,4-dihydro-4-oxo- [ACD/Index Name]
7-[(2S,3Z)-2-(Aminomethyl)-3-(ethoxyimino)-1-azetidinyl]-6-fluor-1-[(1R,2S)-2-fluorcyclopropyl]-4-oxo-1,4-dihydro-1,8-naphthyridin-3-carbonsäure [German] [ACD/IUPAC Name]
7-[(2S,3Z)-2-(Aminomethyl)-3-(ethoxyimino)-1-azetidinyl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid [ACD/IUPAC Name]
Acide 7-[(2S,3Z)-2-(aminométhyl)-3-(éthoxyimino)-1-azétidinyl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-4-oxo-1,4-dihydro-1,8-naphtyridine-3-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 644.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 343.5±34.3 °C
Index of Refraction: 1.723
Molar Refractivity: 94.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.10
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 63.1±7.0 dyne/cm
Molar Volume: 239.2±7.0 cm3

Click to predict properties on the Chemicalize site


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