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1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-6-fluoro-1-(2-fluoroethyl)-4-oxo-7-(1-piperazinyl)-

HCID 3069002
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
84209-34-7
Standard SMILES
O=C(O)c1cn(CCF)c2nc(N3CCNCC3)c(F)cc2c1=O
InChIKey
UDVOCWCSFKHVEL-UHFFFAOYSA-N
Molecular formula
C15H16F2N4O3
Average molar mass
338.31 g/mol
Monoisotopic mass
338.11904671

Names & identifiers

Preferred name
1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-6-fluoro-1-(2-fluoroethyl)-4-oxo-7-(1-piperazinyl)-
IUPAC
6-fluoro-1-(2-fluoroethyl)-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid
English name
1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-6-fluoro-1-(2-fluoroe thyl)-4-oxo-7-(1-piperazinyl)-
Molecular formula
C15H16F2N4O3
Molecular weight
338.31

Names & synonyms

84209-34-7BRN 60738011,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-6-fluoro-1-(2-fluoroethyl)-4-oxo-7-(1-piperazinyl)-DTXSID60233130RefChem:221876DTXCID601556211,4-Dihydro-6-Fluoro-1-(2-Fluoroethyl)-4-Oxo-7-(1-Piperazinyl)-1,8-Naphthyridine-3-Carboxylic AcidCHEMBL291131SCHEMBL11006503UDVOCWCSFKHVEL-UHFFFAOYSA-N6-fluoro-1-(2-fluoroethyl)-1,4-dihydro-4-oxo-7-(1-piperazinyl)-1,8-naphthyridine-3-carboxylic acid6-Fluoro-1-(2-fluoroethyl)-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid
Show more names
1,8-Naphthyridine-3-carboxylic acid, 6-fluoro-1-(2-fluoroethyl)-1,4-dihydro-4-oxo-7-(1-piperazinyl)-1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-6-fluoro-1-(2-fluoroe thyl)-4-oxo-7-(1-piperazinyl)-

Properties

Computed structural properties

XLogP
-0.2
Topological polar surface area
85.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
4
Heavy atoms
24
Formal charge
0
Complexity
539

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

Related reactions

5 records
New reaction record
HRID 309528 reaction equation
HRID 309528As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1145210 reaction equation
HRID 1145210As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 2413119 reaction equation
HRID 2413119As reactantuspto-grants-1985_01
HRID 2413123 reaction equation
HRID 2413123As productuspto-grants-1985_01
HRID 2413124 reaction equation
HRID 2413124As reactantuspto-grants-1985_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
84209-34-7
PubChem CID
3069002
DTXSID
DTXSID60233130
ChEMBL
CHEMBL291131