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Basic information
- Standard SMILES
CCC(CO)N1C(=O)C(C)(CC(=O)OC)CC(c2cccc(Cl)c2)C1c1ccc(Cl)cc1- InChIKey
RNIKWMNKXVLNEP-UHFFFAOYSA-N- Molecular formula
- C25H29Cl2NO4
- Average molar mass
- 478.4 g/mol
- Monoisotopic mass
- 477.1473638
Names & identifiers
- Preferred name
- Methyl 2-[5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-(1-hydroxybutan-2-yl)-3-methyl-2-oxopiperidin-3-yl]acetate
- IUPAC
- methyl 2-[5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-(1-hydroxybutan-2-yl)-3-methyl-2-oxopiperidin-3-yl]acetate
Database identifiers
- PubChem CID
- 76834733
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 654
Related reactions
2 records
Compound notes
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