Bempedoic acid-ezetimibe mixt.
Basic information
- CAS
2561490-29-5- Standard SMILES
CC(C)(CCCCCC(O)CCCCCC(C)(C)C(=O)O)C(=O)O.O=C1[C@H](CC[C@H](O)c2ccc(F)cc2)[C@@H](c2ccc(O)cc2)N1c1ccc(F)cc1- InChIKey
MKGUXOHPHJGYGC-HZLAGBECSA-N- Molecular formula
- C43H57F2NO8
- Average molar mass
- 753.9 g/mol
- Monoisotopic mass
- 753.4052241
Names & identifiers
- Preferred name
- Bempedoic acid-ezetimibe mixt.
- IUPAC
- (3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one;8-hydroxy-2,2,14,14-tetramethylpentadecanedioic acid
Names & synonyms
Bempedoic acid-ezetimibe mixt.DTXSID3013372072561490-29-5
Database identifiers
- CAS
2561490-29-5- PubChem CID
- 91664366
- DTXSID
DTXSID301337207
Properties
Computed structural properties
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 20
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 918
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Compound notes
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