3-{4-[3-(2-fluorophenyl)ureido]phenyl}-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

HCID 57445293
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Basic information

Standard SMILES
NC(=O)c1[nH]c2ncccc2c1-c1ccc(NC(=O)Nc2ccccc2F)cc1
InChIKey
SHRJKKHKJVUVMX-UHFFFAOYSA-N
Molecular formula
C21H16FN5O2
Average molar mass
389.4 g/mol
Monoisotopic mass
389.12880293

Names & identifiers

Preferred name
3-{4-[3-(2-fluorophenyl)ureido]phenyl}-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
IUPAC
3-[4-[(2-fluorophenyl)carbamoylamino]phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

Names & synonyms

SCHEMBL1879963SHRJKKHKJVUVMX-UHFFFAOYSA-N3-{4-[3-(2-fluorophenyl)ureido]phenyl}-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

Database identifiers

PubChem CID
57445293

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
113 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
29

Related reactions

2 records
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Compound notes

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