ChemSpider 2D Image | 1-Cyclopropyl-7-[(3Z)-3-(ethoxyimino)-4-(N-hydroxycarbamimidoyl)-1-pyrrolidinyl]-6-fluoro-8-methoxy-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid | C21H24FN5O6

1-Cyclopropyl-7-[(3Z)-3-(ethoxyimino)-4-(N-hydroxycarbamimidoyl)-1-pyrrolidinyl]-6-fluoro-8-methoxy-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

  • Molecular FormulaC21H24FN5O6
  • Average mass461.444 Da
  • Monoisotopic mass461.171051 Da
  • ChemSpider ID26368032

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Cyclopropyl-7-[(3Z)-3-(ethoxyimino)-4-(N-hydroxycarbamimidoyl)-1-pyrrolidinyl]-6-fluor-8-methoxy-4-oxo-1,4-dihydro-3-chinolincarbonsäure [German] [ACD/IUPAC Name]
1-Cyclopropyl-7-[(3Z)-3-(ethoxyimino)-4-(N-hydroxycarbamimidoyl)-1-pyrrolidinyl]-6-fluoro-8-methoxy-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid [ACD/IUPAC Name]
3-Quinolinecarboxylic acid, 1-cyclopropyl-7-[(3Z)-3-(ethoxyimino)-4-[(hydroxyamino)iminomethyl]-1-pyrrolidinyl]-6-fluoro-1,4-dihydro-8-methoxy-4-oxo- [ACD/Index Name]
Acide 1-cyclopropyl-7-[(3Z)-3-(éthoxyimino)-4-(N-hydroxycarbamimidoyl)-1-pyrrolidinyl]-6-fluoro-8-méthoxy-4-oxo-1,4-dihydro-3-quinoléinecarboxylique [French] [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: 747.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 405.9±35.7 °C
Index of Refraction: 1.698
Molar Refractivity: 110.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.17
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 4.49
ACD/KOC (pH 5.5): 97.89
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.26
Polar Surface Area: 150 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 62.3±7.0 dyne/cm
Molar Volume: 287.3±7.0 cm3

Click to predict properties on the Chemicalize site


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