Basic information
- Standard SMILES
CCC(Oc1ccccc1)C(=O)N1CCN(Cc2ccccc2)CC1.Cl- InChIKey
QXKPKIABBHKCIL-UHFFFAOYSA-N- Molecular formula
- C21H27ClN2O2
- Average molar mass
- 374.9 g/mol
Names & identifiers
- Preferred name
- 1-(2-Phenoxybutyryl)-4-benzylpiperazine hydrochloride
- IUPAC
- 1-(4-benzylpiperazin-1-yl)-2-phenoxybutan-1-one;hydrochloride
Names & synonyms
SCHEMBL8887455QXKPKIABBHKCIL-UHFFFAOYSA-N1-(2-phenoxybutyryl)-4-benzylpiperazine hydrochloride
Database identifiers
- PubChem CID
- 21472265
Properties
Computed structural properties
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 395
Related reactions
2 records
Compound notes
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