ChemSpider 2D Image | (3S)-10-(4-Amino-1-piperazinyl)-9-fluoro-3-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid | C17H19FN4O4

(3S)-10-(4-Amino-1-piperazinyl)-9-fluoro-3-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid

  • Molecular FormulaC17H19FN4O4
  • Average mass362.356 Da
  • Monoisotopic mass362.139038 Da
  • ChemSpider ID25053063

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-10-(4-Amino-1-piperazinyl)-9-fluor-3-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]chinolin-6-carbonsäure [German] [ACD/IUPAC Name]
(3S)-10-(4-Amino-1-piperazinyl)-9-fluoro-3-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid [ACD/IUPAC Name]
7H-1,4-Oxazino[2,3,4-ij]quinoline-6-carboxylic acid, 10-(4-amino-1-piperazinyl)-9-fluoro-2,3-dihydro-3-methyl-7-oxo-, (3S)- [ACD/Index Name]
Acide (3S)-10-(4-amino-1-pipérazinyl)-9-fluoro-3-méthyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoléine-6-carboxylique [French] [ACD/IUPAC Name]
(2S)-6-(4-aminopiperazin-1-yl)-7-fluoro-2-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid
(3s)-10-(4-Aminopiperazin-1-Yl)-9-Fluoro-7-Hydroxy-3-Methyl-2,3-Dihydro-8h-[1,4]oxazino[2,3,4-Ij]quinoline-6-Carboxylate
(S)-10-(4-aminopiperazin-1-yl)-9-fluoro-3-methyl-7-oxo-3,7-dihydro-2H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid
1152314-49-2 [RN]
7H-Pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid, 10-(4-amino-1-piperazinyl)-9-fluoro-2,3-dihydro-3-methyl-7-oxo-, (3S)-
BF 5
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

PubChem Substance ID 329825761 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 605.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 320.3±31.5 °C
Index of Refraction: 1.707
Molar Refractivity: 90.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.04
ACD/LogD (pH 5.5): -1.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 99 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 82.0±5.0 dyne/cm
Molar Volume: 231.3±5.0 cm3

Click to predict properties on the Chemicalize site


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