Basic information
- CAS
127293-56-5- Standard SMILES
O[C@H](CN1CCC(Cc2ccc(F)cc2)CC1)c1ccc(Cl)cc1- InChIKey
GGUSQTSTQSHJAH-HXUWFJFHSA-N- Molecular formula
- C20H23ClFNO
- Average molar mass
- 347.9 g/mol
- Monoisotopic mass
- 347.1452202
Overview
(S)-eliprodil is the S-enantiomer of eliprodil. It is an enantiomer of a (R)-eliprodil.
Names & identifiers
- Preferred name
- (+)-(S)-Eliprodil
- IUPAC
- (1S)-1-(4-chlorophenyl)-2-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]ethanol
Names & synonyms
(+)-(S)-EliprodilEliprodil, (S)-F55QD5KNRVCHEMBL28565127293-56-5(S)-EliprodilS-eliprodilUNII-F55QD5KNRVSCHEMBL7517402CHEBI:180649BDBM50089760(1S)-1-(4-chlorophenyl)-2-{4-[(4-fluorophenyl)methyl]piperidin-1-yl}ethan-1-ol
Show more names
NS00068101(1S)-1-(4-chlorophenyl)-2-[4-(4-fluorobenzyl)piperidin-1-yl]ethanol(S)-1-(4-Chloro-phenyl)-2-[4-(4-fluoro-benzyl)-piperidin-1-yl]-ethanol1-Piperidineethanol, alpha-(4-chlorophenyl)-4-((4-fluorophenyl)methyl)-, (alphaS)-1-PIPERIDINEETHANOL, .ALPHA.-(4-CHLOROPHENYL)-4-((4-FLUOROPHENYL)METHYL)-, (.ALPHA.S)-
Database identifiers
- CAS
127293-56-5- PubChem CID
- 14622158
- ChEMBL
CHEMBL28565- ChEBI
CHEBI:180649- UNII
- F55QD5KNRV
- Nikkaji
- J263.717K
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 359
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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