146897-68-9 Purity
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Specification
The molecular formula of alatrofloxacin is C26H25F3N6O5.
Alatrofloxacin was created on August 9, 2005, and modified on December 30, 2023.
The molecular weight of alatrofloxacin is 558.5 g/mol.
The IUPAC name of alatrofloxacin is 7-[(1S,5R)-6-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-3-azabicyclo[3.1.0]hexan-3-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid.
The InChI key of alatrofloxacin is UUZPPAMZDFLUHD-LZGARRQBSA-N.
The Canonical SMILES of alatrofloxacin is CC(C(=O)NC(C)C(=O)NC1C2C1CN(C2)C3=C(C=C4C(=O)C(=CN(C4=N3)C5=C(C=C(C=C5)F)F)C(=O)O)F)N.
The ChEMBL ID of alatrofloxacin is CHEMBL1201197.
The XLogP3 value of alatrofloxacin is -0.2.
Alatrofloxacin has 4 hydrogen bond donor counts.
The topological polar surface area of alatrofloxacin is 158 Å^2.