Basic information
- CAS
21263-13-8- Standard SMILES
COc1ccc(C(=O)C(C)CN2CCN(CC(OC)c3ccccc3)CC2)cc1.Cl.Cl- InChIKey
WLGVTPHYGHMSFY-UHFFFAOYSA-N- Molecular formula
- C24H34Cl2N2O3
- Average molar mass
- 469.4 g/mol
- Monoisotopic mass
- 468.1946483
Names & identifiers
- Preferred name
- Propiophenone, 4'-methoxy-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-2-methyl-, dihydrochloride
- IUPAC
- 1-(4-methoxyphenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]-2-methylpropan-1-one;dihydrochloride
Names & synonyms
Propiophenone, 4'-methoxy-3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-2-methyl-, dihydrochloride21263-13-8RefChem:375485DTXSID909436941-(4-Methoxyphenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]-2-methylpropan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
21263-13-8- PubChem CID
- 210447
- DTXSID
DTXSID90943694
Properties
Computed structural properties
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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