1-(4-Fluorophenyl)-2-hydroxy-4-(4-phenyl-1-piperazinyl)-1-butanone
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Basic information
- CAS
51037-47-9- Standard SMILES
O=C(c1ccc(F)cc1)C(O)CCN1CCN(c2ccccc2)CC1- InChIKey
DTQPKKCVUDORIM-UHFFFAOYSA-N- Molecular formula
- C20H23FN2O2
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.17435614
Names & identifiers
- Preferred name
- 1-(4-Fluorophenyl)-2-hydroxy-4-(4-phenyl-1-piperazinyl)-1-butanone
- IUPAC
- 1-(4-fluorophenyl)-2-hydroxy-4-(4-phenylpiperazin-1-yl)butan-1-one
- English name
- 4'-fluoro-2-hydroxy-4-(4-phenylpiperazin-1-yl)butyrophenone
- Molecular formula
- C20H23FN2O2
- Molecular weight
- 342.41
Names & synonyms
51037-47-91-(4-Fluorophenyl)-2-hydroxy-4-(4-phenyl-1-piperazinyl)-1-butanoneRefChem:10543694'-Fluoro-2-hydroxy-4-(4-phenylpiperazin-1-yl)butyrophenoneEINECS 256-929-9BRN 08432531-(4-fluorophenyl)-2-hydroxy-4-(4-phenylpiperazin-1-yl)butan-1-one4'-Fluoro-2-hydroxy-4-(4-phenyl-1-piperazinyl)butyrophenoneBUTYROPHENONE, 4'-FLUORO-2-HYDROXY-4-(4-PHENYL-1-PIPERAZINYL)-CHEMBL1190941SCHEMBL11831658DTXSID50965317
Show more names
4'-Fluoro-α-hydroxy-γ-(4-phenyl-1-piperazinyl)butyrophenone1-Butanone, 1-(4-fluorophenyl)-2-hydroxy-4-(4-phenyl-1-piperazinyl)-
DTQPKKCVUDORIM-UHFFFAOYSA-NDB-272293NS000571374'-FLUORO-2-HYDROXY-4-(4-PHENYLPIPERAZIN-1-YL )BUTYROPHENONE
Database identifiers
- CAS
51037-47-9- PubChem CID
- 39881
- DTXSID
DTXSID50965317- ChEMBL
CHEMBL1190941- EC Number
- 256-929-9
- Nikkaji
- J67.461C
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 412
Related reactions
0 records
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Compound notes
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