Basic information
- Standard SMILES
COc1cc(N2CCN(CCc3ccccn3)CC2)c2oc(C(=O)N(C)C)cc2c1- InChIKey
GCWPXICDMYAAJZ-UHFFFAOYSA-N- Molecular formula
- C23H28N4O3
- Average molar mass
- 408.5 g/mol
- Monoisotopic mass
- 408.21614077
Names & identifiers
- Preferred name
- 5-Methoxy-N,N-dimethyl-7-(4-(2-(pyridin-2-yl)ethyl)piperazin-1-yl)benzofuran-2-carboxamide
- IUPAC
- 5-methoxy-N,N-dimethyl-7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-carboxamide
Names & synonyms
SCHEMBL932678CHEMBL3650045GCWPXICDMYAAJZ-UHFFFAOYSA-NBDBM136366US8859534, 525-Methoxy-N,N-dimethyl-7-(4-(2-(pyridin-2-yl)ethyl)piperazin-1-yl)benzofuran-2-carboxamide
Database identifiers
- PubChem CID
- 59636711
- ChEMBL
CHEMBL3650045
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 62.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 567
Related reactions
3 records
Linked notes
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