Moxifloxacin N-sulfate

Base Information

• Chemical Name: Moxifloxacin N-sulfate
• CAS No.: 234080-64-9
• Molecular Formula: C21H24FN3O7S
• Molecular Weight: 481.5
• UNII: 9EI1SIA8XV
• Nikkaji Number: J1.105.874D
• Wikidata: Q27272447
• Mol file: 234080-64-9.mol

Synonyms:Moxifloxacin N-sulfate;234080-64-9;UNII-9EI1SIA8XV;9EI1SIA8XV;7-[(4aS,7aS)-1-sulfo-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-6-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;Moxifloxacin N-Sulfate (sodium salt);MOXIFLOXACIN 1-SULFATE;Q27272447;1,4-Dihydro-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(2,3,4,4aalpha,5,6,7,7aalpha-octahydro-1-sulfo-1H-pyrrolo[3,4-b]pyridine-6-yl)quinoline-3-carboxylic acid;1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-8-METHOXY-7-((4AS,7AS)-OCTAHYDRO-1-SULFO-6H-PYRROLO(3,4-B)PYRIDIN-6-YL)-4-OXO-3-QUINOLINECARBOXYLIC ACID

Chemical Property of Moxifloxacin N-sulfate

Chemical Property:

• PKA: 1.43±0.20(Predicted)
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 5
• Exact Mass: 481.13189945
• Heavy Atom Count: 33
• Complexity: 965

Purity/Quality:

99% ^*data from raw suppliers

MOXIFLOXACIN-N-SULFATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=C2C(=CC(=C1N3CC4CCCN(C4C3)S(=O)(=O)O)F)C(=O)C(=CN2C5CC5)C(=O)O
• Isomeric SMILES: COC1=C2C(=CC(=C1N3C[C@@H]4CCCN([C@@H]4C3)S(=O)(=O)O)F)C(=O)C(=CN2C5CC5)C(=O)O