ChemSpider 2D Image | 7-(4-{N-[(3-Chlorophenyl)sulfonyl]carbamimidoyl}-1-piperazinyl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid | C24H23ClFN5O5S

7-(4-{N-[(3-Chlorophenyl)sulfonyl]carbamimidoyl}-1-piperazinyl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

  • Molecular FormulaC24H23ClFN5O5S
  • Average mass547.986 Da
  • Monoisotopic mass547.109253 Da
  • ChemSpider ID127437556

More details:

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

3-Quinolinecarboxylic acid, 7-[4-[[[(3-chlorophenyl)sulfonyl]amino]iminomethyl]-1-piperazinyl]-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo- [ACD/Index Name]
7-(4-{N-[(3-Chlorophenyl)sulfonyl]carbamimidoyl}-1-piperazinyl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid [ACD/IUPAC Name]
7-(4-{N-[(3-Chlorphenyl)sulfonyl]carbamimidoyl}-1-piperazinyl)-1-cyclopropyl-6-fluor-4-oxo-1,4-dihydro-3-chinolincarbonsäure [German] [ACD/IUPAC Name]
Acide 7-(4-{N-[(3-chlorophényl)sulfonyl]carbamimidoyl}-1-pipérazinyl)-1-cyclopropyl-6-fluoro-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: 757.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.8±3.0 kJ/mol
Flash Point: 411.8±35.7 °C
Index of Refraction: 1.735
Molar Refractivity: 134.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 1.75
ACD/BCF (pH 5.5): 12.26
ACD/KOC (pH 5.5): 203.92
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 1.55
ACD/KOC (pH 7.4): 25.82
Polar Surface Area: 142 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 69.2±7.0 dyne/cm
Molar Volume: 334.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement