Basic information
- CAS
17755-84-9- Standard SMILES
COc1cc(C(=O)CCCN2CCN(c3ccccc3)CC2)cc(OC)c1OC.Cl.Cl- InChIKey
ZKLBPVHJWZLLHS-UHFFFAOYSA-N- Molecular formula
- C23H32Cl2N2O4
- Average molar mass
- 471.4 g/mol
- Monoisotopic mass
- 470.1739129
Names & identifiers
- Preferred name
- Butyrophenone, 4-(4-phenylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
- IUPAC
- 4-(4-phenylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)butan-1-one;dihydrochloride
Names & synonyms
17755-84-9BUTYROPHENONE, 4-(4-PHENYLPIPERAZINYL)-3',4',5'-TRIMETHOXY-, DIHYDROCHLORIDE1-Phenyl-4-(3-(3,4,5-trimethoxybenzoyl)propyl)piperazine dihydrochlorideDTXSID601703394-(4-Phenylpiperazinyl)-3',4',5'-trimethoxybutyrophenone dihydrochloridePiperazine, 1-phenyl-4-(3-(3,4,5-trimethoxybenzoyl)propyl)-, dihydrochlorideRefChem:331466DTXCID90928304-(4-Phenylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)butan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
17755-84-9- PubChem CID
- 28741
- DTXSID
DTXSID60170339
Properties
Computed structural properties
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 475
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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