Basic information
- Standard SMILES
Cc1ccc(CCC(=O)c2ccc(N3CCN(c4ccncc4)CC3)cc2)cc1- InChIKey
UVXHZESHENHXOI-UHFFFAOYSA-N- Molecular formula
- C25H27N3O
- Average molar mass
- 385.5 g/mol
- Monoisotopic mass
- 385.21541249
Names & identifiers
- Preferred name
- 1-[4-(4-Methylphenylpropionyl)-phenyl]-4-(4-pyridyl)piperazine
- IUPAC
- 3-(4-methylphenyl)-1-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]propan-1-one
Names & synonyms
SCHEMBL7956788UVXHZESHENHXOI-UHFFFAOYSA-N1-[4-(4-methylphenylpropionyl)-phenyl]-4-(4-pyridyl)piperazine
Database identifiers
- PubChem CID
- 54375062
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 494
Related reactions
2 records
Compound notes
Loading…