N-Desmethyl levofloxacin

C₁₇H₁₈FN₃O₄CAS 117707-40-1347.35 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid Ether Secondary amine Tertiary amine

Properties

Molecular formula: C₁₇H₁₈FN₃O₄
Molar mass: 347.35 g/mol
Exact mass: 347.1281 Da
logP: 1.20Crippen estimate
Polar surface area: 83.8 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

117707-40-1

SMILES

C[C@H]1COC2=C3N1C=C(C(=O)C3=CC(=C2N4CCNCC4)F)C(=O)O

InChIKey

WKRSSAPQZDHYRV-VIFPVBQESA-N

InChI

InChI=1S/C17H18FN3O4/c1-9-8-25-16-13-10(15(22)11(17(23)24)7-21(9)13)6-12(18)14(16)20-4-2-19-3-5-20/h6-7,9,19H,2-5,8H2,1H3,(H,23,24)/t9-/m0/s1

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

Names and synonyms

1 names

Desmethyl levofloxacin

Work with N-Desmethyl levofloxacin

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

Levofloxacin100986-85-482 % similar Ofloxacin82419-36-182 % similar Ofloxacin hydrochloride118120-51-778 % similar Levofloxacin hydrate138199-71-078 % similar Levofloxacin hydrochloride177325-13-278 % similar Levofloxacin Q-acid100986-89-870 % similar 9,10-Difluoro-2,3-dihydro-3-methyl-7-oxo-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid82419-35-070 % similar Pazufloxacin127045-41-463 % similar

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

Elsewhere

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