Basic information
- CAS
21263-28-5- Standard SMILES
COC(CN1CCN(CCC(=O)c2ccc(F)cc2)CC1)c1ccccc1.Cl.Cl- InChIKey
XSCRLHLOLWVUMP-UHFFFAOYSA-N- Molecular formula
- C22H29Cl2FN2O2
- Average molar mass
- 443.4 g/mol
- Monoisotopic mass
- 442.1590117
Names & identifiers
- Preferred name
- Propiophenone, 4'-fluoro-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-, dihydrochloride
- IUPAC
- 1-(4-fluorophenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]propan-1-one;dihydrochloride
Names & synonyms
21263-28-54'-Fluoro-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)propiophenone dihydrochloridePropiophenone, 4'-fluoro-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-, dihydrochlorideRefChem:375458DTXSID809437091-(4-Fluorophenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]propan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
21263-28-5- PubChem CID
- 210477
- DTXSID
DTXSID80943709
Properties
Computed structural properties
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 440
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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