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1-(quinolin-4-yl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

HCID 21110063
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=C(O)c1cn(-c2ccnc3ccccc23)c2ncccc12
InChIKey
DICAZSNSOSEVNP-UHFFFAOYSA-N
Molecular formula
C17H11N3O2
Average molar mass
289.29 g/mol

Names & identifiers

Preferred name
1-(quinolin-4-yl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
IUPAC
1-quinolin-4-ylpyrrolo[2,3-b]pyridine-3-carboxylic acid

Names & synonyms

SCHEMBL4060642DICAZSNSOSEVNP-UHFFFAOYSA-N1-(quinolin-4-yl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

Database identifiers

PubChem CID
21110063

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
68 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
430

Related reactions

1 records
New reaction record
HRID 1766144 reaction equation
HRID 1766144As reactantuspto-grants-2007_06

Compound notes

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