4-[5-(2,3-Difluoro-phenyl)-imidazol-1-yl]-1H-pyrrole-2-carboxylic acid

HCID 69288296
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Basic information

Standard SMILES
O=C(O)c1cc(-n2cncc2-c2cccc(F)c2F)c[nH]1
InChIKey
QYPGTSPXPDIPMS-UHFFFAOYSA-N
Molecular formula
C14H9F2N3O2
Average molar mass
289.24 g/mol
Monoisotopic mass
289.06628286

Names & identifiers

Preferred name
4-[5-(2,3-Difluoro-phenyl)-imidazol-1-yl]-1H-pyrrole-2-carboxylic acid
IUPAC
4-[5-(2,3-difluorophenyl)imidazol-1-yl]-1H-pyrrole-2-carboxylic acid

Names & synonyms

SCHEMBL5036482QYPGTSPXPDIPMS-UHFFFAOYSA-N4-[5-(2,3-Difluoro-phenyl)-imidazol-1-yl]-1H-pyrrole-2-carboxylic acid

Database identifiers

PubChem CID
69288296

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
70.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
21

Related reactions

1 records
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Compound notes

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