1H,4H-[1,3]Thiazeto[3,2-A]quinoline-3-carboxylic acid, 6-fluoro-1-methyl-7-[4-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-1-piperazinyl]-4-oxo-, hydrochloride (1:1)
Properties
- Molecular formula
- C21H21ClFN3O6S
- Molar mass
- 497.92 g/mol
- Exact mass
- 497.0824 Da
- logP
- 3.06Crippen estimate
- Polar surface area
- 109.1 Ų
- H-bond donors / acceptors
- 1 / 8
- Rotatable bonds
- 4
Identifiers
CAS number
123447-63-2SMILES
Cc1oc(=O)oc1CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)c2n3C(C)S2)CC1.ClInChIKey
PCYBJDKXYFMLCJ-UHFFFAOYSA-NInChI
InChI=1S/C21H20FN3O6S.ClH/c1-10-16(31-21(29)30-10)9-23-3-5-24(6-4-23)15-8-14-12(7-13(15)22)18(26)17(20(27)28)19-25(14)11(2)32-19;/h7-8,11H,3-6,9H2,1-2H3,(H,27,28);1HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
2 names
- 1H,4H-[1,3]Thiazeto[3,2-a]quinoline-3-carboxylic acid, 6-fluoro-1-methyl-7-[4-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-1-piperazinyl]-4-oxo-, monohydrochloride
- 1,3-Dioxole, 1H,4H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid deriv.
Work with 1H,4H-[1,3]Thiazeto[3,2-A]quinoline-3-carboxylic acid, 6-fluoro-1-methyl-7-[4-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-1-piperazinyl]-4-oxo-, hydrochloride (1:1)
Similar compounds
Prulifloxacin123447-62-196 % similar
Ulifloxacin112984-60-864 % similar
Ethyl 6-fluoro-1-methyl-4-oxo-7-(1-piperazinyl)-1H,4H-[1,3]thiazeto[3,2-A]quinoline-3-carboxylate113028-17-448 % similar
Enrofloxacin hydrochloride112732-17-944 % similar
Ethyl 6,7-difluoro-1-methyl-4-oxo-1H,4H-[1,3]thiazeto[3,2-A]quinoline-3-carboxylate113046-72-341 % similar
Enrofloxacin93106-60-641 % similar
Norfloxacin hydrochloride104142-93-040 % similar
3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, hydrochloride (1:?)86483-48-940 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds