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RP60556A

HCID 484065
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cn1cc(C(=O)O)c(=O)c2cc3cc(F)c(N4CCN(c5ccc(F)cc5)CC4)cc3nc21
InChIKey
YYHFVZLNDMSUBV-UHFFFAOYSA-N
Molecular formula
C24H20F2N4O3
Average molar mass
450.4 g/mol
Monoisotopic mass
450.15034684

Overview

structure in first source

Names & identifiers

Preferred name
RP60556A
IUPAC
7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxobenzo[b][1,8]naphthyridine-3-carboxylic acid

Names & synonyms

RP60556A7-fluoro-8-(4-(4-fluorophenyl)piperazin-1-yl)-1-methyl-4-oxopyrido(6,5-b)quinoline-3-carboxylic acid7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxopyrido[6,5-b]quinoline-3-carboxylic acidRefChem:180029RP 60556A7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine-3-carboxylic acidSCHEMBL6603300CHEMBL1183217GTPL11006YYHFVZLNDMSUBV-UHFFFAOYSA-N7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxobenzo[b][1,8]naphthyridine-3-carboxylic acid7-fluoro-8-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-4-oxo-benzo[b][1,8]naphthyridine-3-carboxylic acid
Show more names
7-Fluoro-8-[4-(4-fluorophenyl)piperazinyl]-1-methyl-4-oxohydropyridino[2,3-b]quinoline-3-carboxylic acid

Database identifiers

PubChem CID
484065
ChEMBL
CHEMBL1183217
Nikkaji
J1.518.531G

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
77 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
3
Heavy atoms
33
Formal charge
0
Complexity
795

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Related reactions

7 records
New reaction record
HRID 1266154 reaction equation
HRID 1266154As productuspto-grants-2003_04
HRID 1266155 reaction equation
HRID 1266155As reactantuspto-grants-2003_04
HRID 1266156 reaction equation
HRID 1266156As productuspto-grants-2003_04
HRID 1266157 reaction equation
HRID 1266157As productuspto-grants-2003_04
HRID 2147543 reaction equation
HRID 2147543As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2310426 reaction equation
HRID 2310426As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID 2329492 reaction equation
HRID 2329492As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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