(3R)-3-{3-[(Benzylamino)carbonyl]-1,2,4-oxadiazol-5-yl}-6-cyclohexylhexanoic acid
Basic information
- Standard SMILES
O=C(O)C[C@@H](CCCC1CCCCC1)c1nc(C(=O)NCc2ccccc2)no1- InChIKey
YAUALZKWXPNKRN-GOSISDBHSA-N- Molecular formula
- C22H29N3O4
- Average molar mass
- 399.5 g/mol
- Monoisotopic mass
- 399.21580641
Names & identifiers
- Preferred name
- (3R)-3-{3-[(Benzylamino)carbonyl]-1,2,4-oxadiazol-5-yl}-6-cyclohexylhexanoic acid
- IUPAC
- (3R)-3-[3-(benzylcarbamoyl)-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoic acid
Names & synonyms
SCHEMBL6428677YAUALZKWXPNKRN-GOSISDBHSA-N(3R)-3-{3-[(Benzylamino)carbonyl]-1,2,4-oxadiazol-5-yl}-6-cyclohexylhexanoic acid
Database identifiers
- PubChem CID
- 59909754
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 518
Related reactions
2 records
Compound notes
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