N-((1-Methyl-1H-imidazol-4-yl)methyl)-7-(4-(2-(pyridin-2-yl)ethyl)piperazin-1-yl)benzofuran-2-carboxamide

HCID 59636775

Basic information

Standard SMILES
Cn1cnc(CNC(=O)c2cc3cccc(N4CCN(CCc5ccccn5)CC4)c3o2)c1
InChIKey
UJXLXQFGNRFHSK-UHFFFAOYSA-N
Molecular formula
C25H28N6O2
Average molar mass
444.5 g/mol

Names & identifiers

Preferred name
N-((1-Methyl-1H-imidazol-4-yl)methyl)-7-(4-(2-(pyridin-2-yl)ethyl)piperazin-1-yl)benzofuran-2-carboxamide
IUPAC
N-[(1-methylimidazol-4-yl)methyl]-7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-carboxamide

Names & synonyms

SCHEMBL932193CHEMBL3647263UJXLXQFGNRFHSK-UHFFFAOYSA-NBDBM136319US8859534, 5N-((1-Methyl-1H-imidazol-4-yl)methyl)-7-(4-(2-(pyridin-2-yl)ethyl)piperazin-1-yl)benzofuran-2-carboxamide

Database identifiers

PubChem CID
59636775
ChEMBL
CHEMBL3647263

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
79.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
33

Related reactions

3 records

Compound notes

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