ChemSpider 2D Image | 1-Cyclopropyl-7-[4-(2,2-diphosphonoethyl)-1-piperazinyl]-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid | C19H24FN3O9P2

1-Cyclopropyl-7-[4-(2,2-diphosphonoethyl)-1-piperazinyl]-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

  • Molecular FormulaC19H24FN3O9P2
  • Average mass519.354 Da
  • Monoisotopic mass519.097168 Da
  • ChemSpider ID359646

More details:

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

1-Cyclopropyl-7-[4-(2,2-diphosphonoethyl)-1-piperazinyl]-6-fluor-4-oxo-1,4-dihydro-3-chinolincarbonsäure [German] [ACD/IUPAC Name]
1-Cyclopropyl-7-[4-(2,2-diphosphonoethyl)-1-piperazinyl]-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid [ACD/IUPAC Name]
3-Quinolinecarboxylic acid, 1-cyclopropyl-7-[4-(2,2-diphosphonoethyl)-1-piperazinyl]-6-fluoro-1,4-dihydro-4-oxo- [ACD/Index Name]
7-(4-(2,2-bisphosphonoethyl)piperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Acide 1-cyclopropyl-7-[4-(2,2-diphosphonoéthyl)-1-pipérazinyl]-6-fluoro-4-oxo-1,4-dihydro-3-quinoléinecarboxylique [French] [ACD/IUPAC Name]
1-Cyclopropyl-7-[4-(2,2-diphosphonoethyl)piperazin-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid
7-[4-(2,2-Bis-phosphono-ethyl)-piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid

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

AIDS257681 [DBID]
AIDS-257681 [DBID]
NSC724486 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 886.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.9±3.0 kJ/mol
Flash Point: 489.7±37.1 °C
Index of Refraction: 1.680
Molar Refractivity: 112.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: -2.02
ACD/LogD (pH 5.5): -6.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 199 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 97.6±3.0 dyne/cm
Molar Volume: 298.1±3.0 cm3

Click to predict properties on the Chemicalize site


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