Propiophenone, 3-piperazinylenebis(3',4',5'-trimethoxy-, dihydrochloride
Basic information
- CAS
16760-48-8- Standard SMILES
COc1cc(C(=O)CCN2CCN(CCC(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1OC.Cl.Cl- InChIKey
PKJOGVRBLJQSFS-UHFFFAOYSA-N- Molecular formula
- C28H40Cl2N2O8
- Average molar mass
- 603.5 g/mol
- Monoisotopic mass
- 602.2161716
Names & identifiers
- Preferred name
- Propiophenone, 3-piperazinylenebis(3',4',5'-trimethoxy-, dihydrochloride
- IUPAC
- 3-[4-[3-oxo-3-(3,4,5-trimethoxyphenyl)propyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-one;dihydrochloride
Names & synonyms
1,4-Bis(3,4,5-trimethoxybenzoylethyl)piperazine dihydrochloride3-Piperazinylenebis(3',4',5'-trimethoxypropiophenone) dihydrochloridePropiophenone, 3-piperazinylenebis(3',4',5'-trimethoxy-, dihydrochloride16760-48-8DTXSID60168337Piperazine, 1,4-bis(3,4,5-trimethoxybenzoylethyl)-, dihydrochlorideRefChem:375391DTXCID10908283,3'-(Piperazine-1,4-diyl)bis[1-(3,4,5-trimethoxyphenyl)propan-1-one]--hydrogen chloride (1/2)
Database identifiers
- CAS
16760-48-8- PubChem CID
- 204657
- DTXSID
DTXSID60168337
Properties
Computed structural properties
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 644
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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