Basic information
- CAS
21263-24-1- Standard SMILES
COC(CN1CCN(CCC(=O)c2ccc(Cl)cc2)CC1)c1ccccc1.Cl.Cl- InChIKey
XHZUDOGNJOVGLM-UHFFFAOYSA-N- Molecular formula
- C22H29Cl3N2O2
- Average molar mass
- 459.8 g/mol
- Monoisotopic mass
- 458.129461
Names & identifiers
- Preferred name
- Propiophenone, 4'-chloro-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-, dihydrochloride
- IUPAC
- 1-(4-chlorophenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]propan-1-one;dihydrochloride
Names & synonyms
21263-24-14'-Chloro-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)propiophenone dihydrochloridePropiophenone, 4'-chloro-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-, dihydrochlorideRefChem:375449DTXSID409437051-(4-Chlorophenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]propan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
21263-24-1- PubChem CID
- 210469
- DTXSID
DTXSID40943705
Properties
Computed structural properties
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- 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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