1-Cyclopropyl-6,8-difluoro-5-methyl-7-[3-(1,2,3-triazol-1-yl)pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

HCID 19006002
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Basic information

Standard SMILES
Cc1c(F)c(N2CCC(n3ccnn3)C2)c(F)c2c1c(=O)c(C(=O)O)cn2C1CC1
InChIKey
FEVRQFYSSYKSEB-UHFFFAOYSA-N
Molecular formula
C20H19F2N5O3
Average molar mass
415.4 g/mol
Monoisotopic mass
415.14559581

Names & identifiers

Preferred name
1-Cyclopropyl-6,8-difluoro-5-methyl-7-[3-(1,2,3-triazol-1-yl)pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
IUPAC
1-cyclopropyl-6,8-difluoro-5-methyl-4-oxo-7-[3-(triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid

Names & synonyms

SCHEMBL8136239FEVRQFYSSYKSEB-UHFFFAOYSA-N1-Cyclopropyl-6,8-difluoro-5-methyl-7-[3-(1,2,3-triazol-1-yl)pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Database identifiers

PubChem CID
19006002

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
91.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
4
Heavy atoms
30

Related reactions

2 records
New reaction record

Compound notes

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