N1-(3-fluoro-4-(2-(1-methyl-1H-imidazol-4-yl)thieno[3,2-b]pyridin-7-yloxy)phenyl)-N3-phenylmalonamide

HCID 44565164

Basic information

Standard SMILES
Cn1cnc(-c2cc3nccc(Oc4ccc(NC(=O)CC(=O)Nc5ccccc5)cc4F)c3s2)c1
InChIKey
QVLIPUSWOSVZPQ-UHFFFAOYSA-N
Molecular formula
C26H20FN5O3S
Average molar mass
501.5 g/mol
Monoisotopic mass
501.12708885

Names & identifiers

Preferred name
N1-(3-fluoro-4-(2-(1-methyl-1H-imidazol-4-yl)thieno[3,2-b]pyridin-7-yloxy)phenyl)-N3-phenylmalonamide
IUPAC
N'-[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]-N-phenylpropanediamide

Names & synonyms

CHEMBL464510N1-(3-fluoro-4-(2-(1-methyl-1H-imidazol-4-yl)thieno[3,2-b]pyridin-7-yloxy)phenyl)-N3-phenylmalonamideSCHEMBL306290QVLIPUSWOSVZPQ-UHFFFAOYSA-NBDBM50248556

Database identifiers

PubChem CID
44565164
ChEMBL
CHEMBL464510

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
126 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
36

Related reactions

8 records

Compound notes

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