(R)-tert-butyl 3-((S)-1-(2-(2-ethylphenoxy)phenyl)-1-hydroxy-5-methoxypentyl)piperidine-1-carboxylate
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Basic information
- Standard SMILES
CCc1ccccc1Oc1ccccc1[C@](O)(CCCCOC)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1- InChIKey
VVQDOEHIIKOLRB-HLADLETHSA-N- Molecular formula
- C30H43NO5
- Average molar mass
- 497.7 g/mol
Names & identifiers
- Preferred name
- (R)-tert-butyl 3-((S)-1-(2-(2-ethylphenoxy)phenyl)-1-hydroxy-5-methoxypentyl)piperidine-1-carboxylate
- IUPAC
- tert-butyl (3R)-3-[(1S)-1-[2-(2-ethylphenoxy)phenyl]-1-hydroxy-5-methoxypentyl]piperidine-1-carboxylate
Names & synonyms
SCHEMBL972062VVQDOEHIIKOLRB-HLADLETHSA-N(R)-tert-butyl 3-((S)-1-(2-(2-ethylphenoxy)phenyl)-1-hydroxy-5-methoxypentyl)piperidine-1-carboxylate
Database identifiers
- PubChem CID
- 57786507
Properties
Computed structural propertiesFilling in
- XLogP
- 5.8
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 664
Related reactions
2 records
Compound notes
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