(3R)-6-cyclohexyl-3-{3-[(2-ethoxy-1-methyl-2-oxoethoxy)methyl]-1,2,4-oxadiazol-5-yl}hexanoic acid
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Basic information
- Standard SMILES
CCOC(=O)C(C)OCc1noc([C@H](CCCC2CCCCC2)CC(=O)O)n1- InChIKey
HLKROEAHEONJJT-BZSJEYESSA-N- Molecular formula
- C20H32N2O6
- Average molar mass
- 396.5 g/mol
- Monoisotopic mass
- 396.22603674
Names & identifiers
- Preferred name
- (3R)-6-cyclohexyl-3-{3-[(2-ethoxy-1-methyl-2-oxoethoxy)methyl]-1,2,4-oxadiazol-5-yl}hexanoic acid
- IUPAC
- (3R)-6-cyclohexyl-3-[3-[(1-ethoxy-1-oxopropan-2-yl)oxymethyl]-1,2,4-oxadiazol-5-yl]hexanoic acid
Names & synonyms
SCHEMBL6428547HLKROEAHEONJJT-BZSJEYESSA-N(3R)-6-cyclohexyl-3-{3-[(2-ethoxy-1 -methyl-2-oxoethoxy)methyl]-1,2,4-oxadiazol-5-yl}hexanoic acid(3R)-6-cyclohexyl-3-{3-[(2-ethoxy-1-methyl-2-oxoethoxy)methyl]-1,2,4-oxadiazol-5-yl}hexanoic acid
Database identifiers
- PubChem CID
- 59909830
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 483
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Related reactions
4 records
Compound notes
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