Basic information
- Standard SMILES
C=CCC1(C)CC(c2cccc(Cl)c2)C(c2ccc(Cl)cc2)N(Cc2ccccn2)C1=O- InChIKey
WDTSBDSGQVSRQF-UHFFFAOYSA-N- Molecular formula
- C27H26Cl2N2O
- Average molar mass
- 465.4 g/mol
- Monoisotopic mass
- 464.1422188
Names & identifiers
- Preferred name
- 5-(3-Chlorophenyl)-6-(4-chlorophenyl)-3-methyl-3-prop-2-enyl-1-(pyridin-2-ylmethyl)piperidin-2-one
- IUPAC
- 5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-methyl-3-prop-2-enyl-1-(pyridin-2-ylmethyl)piperidin-2-one
Database identifiers
- PubChem CID
- 76834730
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 650
Related reactions
2 records
Compound notes
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