chempirical

Ciprofloxacin lactate

C20H24FN3O6CAS 97867-33-9421.43 g/mol

Open in Covalent MOL file
HOOOHOHONNNHFO
AlcoholAryl halideCarboxylic acidSecondary amineTertiary amine

Properties

Molecular formula
C20H24FN3O6
Molar mass
421.43 g/mol
Exact mass
421.1649 Da
logP
1.04Crippen estimate
Polar surface area
132.1 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
4

Identifiers

CAS number
97867-33-9
SMILES
CC(O)C(=O)O.O=C(O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O
InChIKey
NRBJWZSFNGZBFQ-UHFFFAOYSA-N
InChI
InChI=1S/C17H18FN3O3.C3H6O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24;1-2(4)3(5)6/h7-10,19H,1-6H2,(H,23,24);2,4H,1H3,(H,5,6)

Weigh it out

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

Names and synonyms

3 names
  • 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, 2-hydroxypropanoate (1:1)
  • 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, mono(2-hydroxypropanoate)
  • Propanoic acid, 2-hydroxy-, compd. with 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid (1:1)

Work with Ciprofloxacin lactate

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

Ciprofloxacin85721-33-183 % similar 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, hydrochloride (1:?)86483-48-979 % similar Ciprofloxacin hydrochloride93107-08-579 % similar Ciprofloxacin hydrochloride monohydrate86393-32-075 % similar Enrofloxacin93106-60-669 % similar Enrofloxacin hydrochloride112732-17-966 % similar 7-Chloro-1-cyclopropyl-4-oxo-6-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid133210-96-564 % similar Norfloxacin70458-96-762 % similar

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

Elsewhere

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