Basic information
- Standard SMILES
COc1cccnc1N1CCN(CCCc2coc3ccccc23)CC1.Cl- InChIKey
PCWPYBAWPHPZRV-UHFFFAOYSA-N- Molecular formula
- C21H26ClN3O2
- Average molar mass
- 387.9 g/mol
Names & identifiers
- Preferred name
- 1-[3-(Benzo[b]furan-3-yl)propyl]-4-(3-methoxy-2-pyridinyl)piperazine hydrochloride
- IUPAC
- 1-[3-(1-benzofuran-3-yl)propyl]-4-(3-methoxy-2-pyridinyl)piperazine;hydrochloride
Names & synonyms
SCHEMBL8787138PCWPYBAWPHPZRV-UHFFFAOYSA-N1-[3-(benzo[b]furan-3-yl)propyl]-4-(3-methoxy-2-pyridinyl)piperazine hydrochloride
Database identifiers
- PubChem CID
- 19081445
Properties
Computed structural properties
- Topological polar surface area
- 41.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 427
Related reactions
1 records
Compound notes
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