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1-(6-Methoxy-3-pyridinyl)-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylic acid

HCID 67009641
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COc1ccc(-n2c(=O)c(C(=O)O)cc3cccnc32)cn1
InChIKey
LTBHMAYVLKNEDT-UHFFFAOYSA-N
Molecular formula
C15H11N3O4
Average molar mass
297.26 g/mol

Names & identifiers

Preferred name
1-(6-Methoxy-3-pyridinyl)-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylic acid
IUPAC
1-(6-methoxy-3-pyridinyl)-2-oxo-1,8-naphthyridine-3-carboxylic acid

Names & synonyms

SCHEMBL1372752LTBHMAYVLKNEDT-UHFFFAOYSA-N1-(6-methoxy-3-pyridinyl)-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylic acid

Database identifiers

PubChem CID
67009641

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
92.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
493

Related reactions

4 records
New reaction record
HRID 1555166 reaction equation
HRID 1555166As productAs reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2194498 reaction equation
HRID 2194498As reactantuspto-grants-2012_12
HRID 2194539 reaction equation
HRID 2194539As productuspto-grants-2012_12
HRID 2336139 reaction equation
HRID 2336139As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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