Basic information
- Standard SMILES
C[C@H](CN1CCN(c2cc(F)c(F)cc2F)CC1)N1C(=O)CC2(CCCC2)CC1=O- InChIKey
WCWNYVYNQAPOOX-OAHLLOKOSA-N- Molecular formula
- C22H28F3N3O2
- Average molar mass
- 423.5 g/mol
Names & identifiers
- Preferred name
- 8-[(2R)-1-[4-(2,4,5-trifluorophenyl)piperazin-1-yl]propan-2-yl]-8-azaspiro[4.5]decane-7,9-dione
- IUPAC
- 8-[(2R)-1-[4-(2,4,5-trifluorophenyl)piperazin-1-yl]propan-2-yl]-8-azaspiro[4.5]decane-7,9-dione
Names & synonyms
SNAP-8719CHEMBL98241255893-38-0orb1695196SCHEMBL6753278WCWNYVYNQAPOOX-OAHLLOKOSA-NBDBM50122803AKOS0407540468-[(2R)-1-[4-(2,4,5-trifluorophenyl)piperazin-1-yl]propan-2-yl]-8-azaspiro[4.5]decane-7,9-dioneT34666(SNAP-8719)[4-(4-Amino-6,7-dimethoxy-quinazolin-2-yl)-octahydro-quinoxalin-1-yl]-furan-2-yl-methanone8-{(1R)-2-[4-(2,4,5-Trifluorophenyl)piperazin-1-yl]-1-methylethyl}-8-azaspiro[4.5]decane-7,9-dione
Show more names
8-{(R)-1-Methyl-2-[4-(2,4,5-trifluoro-phenyl)-piperazin-1-yl]-ethyl}-8-aza-spiro[4.5]decane-7,9-dione8-{1-Methyl-2-[4-(2,4,5-trifluoro-phenyl)-piperazin-1-yl]-ethyl}-8-aza-spiro[4.5]decane-7,9-dione
Database identifiers
- PubChem CID
- 9845181
- ChEMBL
CHEMBL98241
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 630
Related reactions
1 records
Compound notes
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