Basic information
- CAS
131948-19-1- Standard SMILES
O=C1CC[C@@](c2ccccc2)(C2CCN(Cc3ccc([18F])cc3)CC2)C(=O)N1- InChIKey
VTMACVBTDNAUST-PCDXLLNQSA-N- Molecular formula
- C23H25FN2O2
- Average molar mass
- 379.5 g/mol
- Monoisotopic mass
- 379.19254
Overview
structure given in first source; RN given refers to 18F-labeled cpd
Names & identifiers
- Preferred name
- 4-Fluorodexetimide
- IUPAC
- (3S)-3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-3-phenylpiperidine-2,6-dione
- English name
- 4-fluorodexetimide
- Molecular weight
- 0
Names & synonyms
4-Fluorodexetimide131948-19-1DTXSID90157274RefChem:912518DTXCID5079765(3,4'-Bipiperidine)-2,6-dione, 1'-((4-(fluoro-18F)phenyl)methyl)-3-phenyl-, (S)-MOLI000126MOLI001405(3S)-1'-{[4-(~18~F)Fluorophenyl]methyl}-3-phenyl[3,4'-bipiperidine]-2,6-dione(3S)-3-[1-(4-Fluorobenzyl)-4-piperidyl]-3-phenylpiperidine-2,6-dione
Database identifiers
- CAS
131948-19-1- PubChem CID
- 449730
- DTXSID
DTXSID90157274- Nikkaji
- J3.079.744B
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 561
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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