chempirical

Tosufloxacin

C19H15F3N4O3CAS 100490-36-6404.35 g/mol

Open in Covalent MOL file
H2NNNFOOOHNFF
Aryl halideCarboxylic acidPrimary amineTertiary amine

Properties

Molecular formula
C19H15F3N4O3
Molar mass
404.35 g/mol
Exact mass
404.1096 Da
logP
2.04Crippen estimate
Polar surface area
101.5 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
3

Identifiers

CAS number
100490-36-6
SMILES
NC1CCN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3-c2ccc(F)cc2F)C1
InChIKey
WUWFMDMBOJLQIV-UHFFFAOYSA-N
InChI
InChI=1S/C19H15F3N4O3/c20-9-1-2-15(13(21)5-9)26-8-12(19(28)29)16(27)11-6-14(22)18(24-17(11)26)25-4-3-10(23)7-25/h1-2,5-6,8,10H,3-4,7,23H2,(H,28,29)

Weigh it out

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

Names and synonyms

8 names
  • 1,8-Naphthyridine-3-carboxylic acid, 7-(3-amino-1-pyrrolidinyl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-
  • 7-(3-Amino-1-pyrrolidinyl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid
  • A 61827
  • A 67107
  • Abbott 61827
  • Tosulfloxacin
  • 1-(2,4-Difluorophenyl)-6-fluoro-1,4-dihydro-7-(3-aminopyrrolidin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid
  • Dl-Tosufloxacin

Work with Tosufloxacin

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

Tosufloxacin monohydrate107097-79-096 % similar Tosufloxacin tosylate115964-29-980 % similar Clinafloxacin105956-97-653 % similar Enoxacin74011-58-848 % similar Ethyl 7-chloro-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate100491-29-046 % similar Enoxacin sesquihydrate84294-96-246 % similar Gemifloxacin175463-14-645 % similar Sarafloxacin98105-99-843 % similar

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

Same formula

Tosufloxacin108138-46-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook