Basic information
- CAS
17821-66-8- Standard SMILES
COc1cc(C(=O)CCN2CCN(CCc3ccccc3)CC2)cc(OC)c1OC.Cl.Cl- InChIKey
NIBMTOCWYCNSHD-UHFFFAOYSA-N- Molecular formula
- C24H34Cl2N2O4
- Average molar mass
- 485.4 g/mol
- Monoisotopic mass
- 484.189563
Names & identifiers
- Preferred name
- Propiophenone, 3-(4-phenethylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
- IUPAC
- 3-[4-(2-phenylethyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-one;dihydrochloride
Names & synonyms
Propiophenone, 3-(4-phenethylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride1-(2-Phenethyl)-4-(3,4,5-trimethoxybenzoylethyl)piperazine dihydrochloride17821-66-8DTXSID701704413-(4-Phenethylpiperazinyl)-3',4',5'-trimethoxypropiophenone dihydrochloridePiperazine, 1-(2-phenethyl)-4-(3,4,5-trimethoxybenzoylethyl)-, dihydrochlorideRefChem:375369DTXCID20929323-[4-(2-Phenylethyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
17821-66-8- PubChem CID
- 205358
- DTXSID
DTXSID70170441
Properties
Computed structural properties
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 489
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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