Basic information
- CAS
65976-18-3- Standard SMILES
CC(=O)c1cccc(OCCCN2CCN(c3ccccc3)CC2)c1- InChIKey
VUDSNWZKAANGCC-UHFFFAOYSA-N- Molecular formula
- C21H26N2O2
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.19942808
Names & identifiers
- Preferred name
- Acetophenone, 3'-(3-(4-phenyl-1-piperazinyl)propoxy)-
- IUPAC
- 1-[3-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]ethanone
Names & synonyms
65976-18-3ACETOPHENONE, 3'-(3-(4-PHENYL-1-PIPERAZINYL)PROPOXY)-BRN 0835230Ethanone, 1-(3-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-DTXSID202161811-{3-[3-(4-Phenylpiperazin-1-yl)propoxy]phenyl}ethan-1-one
Database identifiers
- CAS
65976-18-3- PubChem CID
- 47786
- DTXSID
DTXSID20216181
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 401
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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