1-(4-Fluorophenyl)-6,8-difluoro-7-(3-methyl-3-trifluoroacetamido-1-azetidinyl)-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

HCID 10074656
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Basic information

Standard SMILES
CC1(NC(=O)C(F)(F)F)CN(c2c(F)cc3c(=O)c(C(=O)O)cn(-c4ccc(F)cc4)c3c2F)C1
InChIKey
HUISPBVVUOUAHW-UHFFFAOYSA-N
Molecular formula
C22H15F6N3O4
Average molar mass
499.4 g/mol

Names & identifiers

Preferred name
1-(4-Fluorophenyl)-6,8-difluoro-7-(3-methyl-3-trifluoroacetamido-1-azetidinyl)-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid
IUPAC
6,8-difluoro-1-(4-fluorophenyl)-7-[3-methyl-3-[(2,2,2-trifluoroacetyl)amino]azetidin-1-yl]-4-oxoquinoline-3-carboxylic acid

Names & synonyms

1-(4-fluorophenyl)-6,8-difluoro-7-(3-methyl-3-trifluoroacetamido-1-azetidinyl)-1,4-dihydro-4-oxo-3-quinolinecarboxylic acidSCHEMBL9666765

Database identifiers

PubChem CID
10074656

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
90 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
12
Rotatable bonds
4
Heavy atoms
35

Related reactions

4 records
New reaction record

Compound notes

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