5-(3-Chlorophenyl)-6-(4-chlorophenyl)-3-methyl-1-[1-(methylamino)butan-2-yl]-3-prop-2-enylpiperidin-2-one
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Basic information
- Standard SMILES
C=CCC1(C)CC(c2cccc(Cl)c2)C(c2ccc(Cl)cc2)N(C(CC)CNC)C1=O- InChIKey
JAMQYOLPSKWIFV-UHFFFAOYSA-N- Molecular formula
- C26H32Cl2N2O
- Average molar mass
- 459.4 g/mol
- Monoisotopic mass
- 458.189169
Names & identifiers
- Preferred name
- 5-(3-Chlorophenyl)-6-(4-chlorophenyl)-3-methyl-1-[1-(methylamino)butan-2-yl]-3-prop-2-enylpiperidin-2-one
- IUPAC
- 5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-methyl-1-[1-(methylamino)butan-2-yl]-3-prop-2-enylpiperidin-2-one
Database identifiers
- PubChem CID
- 76834737
Properties
Computed structural propertiesFilling in
- XLogP
- 6.4
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 606
Related reactions
2 records
Compound notes
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