Molecular Identity
Fluspirilene
8-[4,4-bis(4-fluorophenyl)butyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
PubChem CID: 3396
8-[4,4-bis(4-fluorophenyl)butyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one is a diarylmethane.
2D Structure
Properties
C29H31F2N3O
Molecular Formula
475.60
Molecular Weight
g/mol
475.2435
Exact Mass
Da
5.6
XLogP
Above Lipinski threshold
35.6
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
653
Complexity
SMILES
Canonical SMILES
SMILES: C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)FIsomeric SMILES
SMILES: C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)FSynonyms(20)
Fluspirilene1841-19-6RedeptinImapFluspirilenoMcN-JR-62188-[4,4-bis(4-fluorophenyl)butyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-oneR 6218FluspirilenumDTXSID7045152R-6218C5QA4GLR9M8-(4,4-Bis(p-fluorophenyl)butyl)-1-phenyl-1,3,8-triazaspiro-(4.5)decan-4-one1,3,8-Triazaspiro(4.5)decan-4-one, 8-(4,4-bis(4-fluorophenyl)butyl)-1-phenyl-Spirodiflamine
Data from PubChem (NCBI)
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