chempirical

Norfloxacin nicotinate

C22H23FN4O5CAS 118803-81-9442.45 g/mol

Open in Covalent MOL file
NOOHOFNHNOHON
Aryl halideCarboxylic acidSecondary amineTertiary amine

Properties

Molecular formula
C22H23FN4O5
Molar mass
442.45 g/mol
Exact mass
442.1652 Da
logP
2.05Crippen estimate
Polar surface area
124.8 Ų
H-bond donors / acceptors
3 / 6
Rotatable bonds
4

Identifiers

CAS number
118803-81-9
SMILES
CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCNCC3)cc21.O=C(O)c1cccnc1
InChIKey
WRIFLTAYLRDENF-UHFFFAOYSA-N
InChI
InChI=1S/C16H18FN3O3.C6H5NO2/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20;8-6(9)5-2-1-3-7-4-5/h7-9,18H,2-6H2,1H3,(H,22,23);1-4H,(H,8,9)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • 3-Quinolinecarboxylic acid, 1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, compd. with 3-pyridinecarboxylic acid (1:1)
  • 3-Quinolinecarboxylic acid, 1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, mono-3-pyridinecarboxylate
  • 3-Pyridinecarboxylic acid, mono[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylate]

Work with Norfloxacin nicotinate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Norfloxacin70458-96-779 % similar Norfloxacin hydrochloride104142-93-075 % similar Pefloxacin70458-92-364 % similar Enoxacin74011-58-858 % similar Ciprofloxacin85721-33-157 % similar Sarafloxacin98105-99-857 % similar Pefloxacin mesylate70458-95-657 % similar Enoxacin sesquihydrate84294-96-256 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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