Fluspiperone
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Basic information
- CAS
54965-22-9- Standard SMILES
O=C(CCCN1CCC2(CC1)C(=O)NCN2c1ccc(F)cc1)c1ccc(F)cc1- InChIKey
RIOZXKPJYKSKJV-UHFFFAOYSA-N- Molecular formula
- C23H25F2N3O2
- Average molar mass
- 413.5 g/mol
- Monoisotopic mass
- 413.19148337
Overview
Fluspiperone is an aromatic ketone.
Names & identifiers
- Preferred name
- Fluspiperone
- IUPAC
- 1-(4-fluorophenyl)-8-[4-(4-fluorophenyl)-4-oxobutyl]-1,3,8-triazaspiro[4.5]decan-4-one
- English name
- Fluspiperone
- Molecular formula
- C23H25F2N3O2
- Molecular weight
- 413.466
Names & synonyms
Fluspiperone54965-22-91-(4-fluorophenyl)-8-[4-(4-fluorophenyl)-4-oxobutyl]-1,3,8-triazaspiro[4.5]decan-4-oneNSC-354855R 28,930V0Q53N427TR-28930NSC3548551-(4-Fluorophenyl)-8-(4-(4-fluorophenyl)-4-oxobutyl)-1,3,8-triazaspiro[4.5]decan-4-one1,3,8-Triazaspiro(4.5)decan-4-one, 1-(4-fluorophenyl)-8-(4-(4-fluorophenyl)-4-oxobutyl)-8-(3-(p-Fluorobenzoyl)propyl)-1-(p-fluorophenyl)-1,3,8-triazaspiro(4.5)decan-4-oneUNII-V0Q53N427T
Show more names
Fluspiperone USP/EP/BP8-[3-(4-Fluorobenzoyl)propyl]-1-(4-fluorophenyl)-1,3,8-triazaspiro[4.5]decan-4-one1,3,8-Triazaspiro[4.5]decan-4-one, 1-(4-fluorophenyl)-8-[4-(4-fluorophenyl)-4-oxobutyl]-
Fluspiperone [USAN:INN]FluspiperonaNSC 354855Fluspiperone (USAN/INN)FLUSPIPERONE [INN]FLUSPIPERONE [USAN]SCHEMBL121266orb1702256
Database identifiers
- CAS
54965-22-9- PubChem CID
- 166535
- DTXSID
DTXSID20203495- ChEMBL
CHEMBL2104750- ChEBI
CHEBI:177415- UNII
- V0Q53N427T
- Nikkaji
- J11.454E
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 608
Physicochemical properties
- FDA UNII
- 0 Q53N427T · V0Q53N427T
Chemistry & industry
Applications
UsesAntipsychotic.
UsesFluspiperone functions as one of the substances for dopamine neuroleptic receptors blockade with potential for clinical antipsychotics.
Additional notes
DefinitionChEBI: Fluspiperone is an aromatic ketone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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