7-(4-(2-(5-Acetamidopyridin-2-yl)ethyl)piperazin-1-yl)-N,N-dimethylbenzofuran-2-carboxamide

HCID 59636773

Basic information

Standard SMILES
CC(=O)Nc1ccc(CCN2CCN(c3cccc4cc(C(=O)N(C)C)oc34)CC2)nc1
InChIKey
WJWJXULJOUOQIG-UHFFFAOYSA-N
Molecular formula
C24H29N5O3
Average molar mass
435.5 g/mol
Monoisotopic mass
435.2270398

Names & identifiers

Preferred name
7-(4-(2-(5-Acetamidopyridin-2-yl)ethyl)piperazin-1-yl)-N,N-dimethylbenzofuran-2-carboxamide
IUPAC
7-[4-[2-(5-acetamido-2-pyridinyl)ethyl]piperazin-1-yl]-N,N-dimethyl-1-benzofuran-2-carboxamide

Names & synonyms

SCHEMBL931714CHEMBL3650037WJWJXULJOUOQIG-UHFFFAOYSA-NBDBM136358US8859534, 447-(4-(2-(5-Acetamidopyridin-2-yl)ethyl)piperazin-1-yl)-N,N-dimethylbenzofuran-2-carboxamide

Database identifiers

PubChem CID
59636773
ChEMBL
CHEMBL3650037

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
81.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
32

Related reactions

3 records

Compound notes

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