Basic information
- Standard SMILES
CC[C@@H](C=O)N1C(=O)[C@@](C)(CC(=O)OC)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1- InChIKey
HHOPOYVXTHPIAF-KWLZBDKBSA-N- Molecular formula
- C25H27Cl2NO4
- Average molar mass
- 476.4 g/mol
Names & identifiers
- Preferred name
- methyl 2-((3R,5R,6S)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-methyl-2-oxo-1-((S)-1-oxobutan-2-yl)piperidin-3-yl)acetate
- IUPAC
- methyl 2-[(3R,5R,6S)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-methyl-2-oxo-1-[(2S)-1-oxobutan-2-yl]piperidin-3-yl]acetate
Names & synonyms
SCHEMBL9991154HHOPOYVXTHPIAF-KWLZBDKBSA-Nmethyl 2-((3R,5R,6S)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-methyl-2-oxo-1-((S)-1-oxobutan-2-yl)piperidin-3-yl)acetate
Database identifiers
- PubChem CID
- 86660749
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 681
Related reactions
3 records
Compound notes
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