Butyrophenone, 4'-fluoro-4-(4-(beta-propoxyphenethyl)-1-piperazinyl)-, dihydrochloride
Basic information
- CAS
21263-01-4- Standard SMILES
CC(C)OC(Cc1ccccc1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1.Cl.Cl- InChIKey
FGGIWBVIOGDHTB-UHFFFAOYSA-N- Molecular formula
- C25H35Cl2FN2O2
- Average molar mass
- 485.5 g/mol
- Monoisotopic mass
- 484.2059619
Names & identifiers
- Preferred name
- Butyrophenone, 4'-fluoro-4-(4-(beta-propoxyphenethyl)-1-piperazinyl)-, dihydrochloride
- IUPAC
- 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-propan-2-yloxyethyl)piperazin-1-yl]butan-1-one;dihydrochloride
Names & synonyms
21263-01-44'-Fluoro-4-(4-(beta-propoxyphenethyl)-1-piperazinyl)butyrophenone dihydrochlorideButyrophenone, 4'-fluoro-4-(4-(beta-propoxyphenethyl)-1-piperazinyl)-, dihydrochlorideRefChem:331416DTXSID409436841-(4-Fluorophenyl)-4-(4-{2-phenyl-1-[(propan-2-yl)oxy]ethyl}piperazin-1-yl)butan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
21263-01-4- PubChem CID
- 210427
- DTXSID
DTXSID40943684
Properties
Computed structural properties
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 493
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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