Basic information
- Standard SMILES
COc1cccnc1N1CCN(CCCc2csc3ccccc23)C(C)C1.Cl- InChIKey
VFLUICDLHCXKMD-UHFFFAOYSA-N- Molecular formula
- C22H28ClN3OS
- Average molar mass
- 418 g/mol
Names & identifiers
- Preferred name
- 1-[3-(Benzo[b]thien-3-yl)propyl]-4-(3-methoxy-2-pyridinyl)-2-methylpiperazine hydrochloride
- IUPAC
- 1-[3-(1-benzothiophen-3-yl)propyl]-4-(3-methoxy-2-pyridinyl)-2-methylpiperazine;hydrochloride
Names & synonyms
SCHEMBL8787396VFLUICDLHCXKMD-UHFFFAOYSA-N1-[3-(benzo[b]thien-3-yl)propyl]-4-(3-methoxy-2-pyridinyl)-2-methylpiperazine hydrochloride
Database identifiers
- PubChem CID
- 19081472
Properties
Computed structural properties
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 465
Related reactions
7 records
Compound notes
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