2,4-Bis(2-methoxyphenyl)-3-azabicyclo[3.3.1]nonan-9-one
Basic information
- CAS
34143-13-0- Standard SMILES
COc1ccccc1C1NC(c2ccccc2OC)C2CCCC1C2=O- InChIKey
AURMFVOEFKIMJR-UHFFFAOYSA-N- Molecular formula
- C22H25NO3
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.18344366
Names & identifiers
- Preferred name
- 2,4-Bis(2-methoxyphenyl)-3-azabicyclo[3.3.1]nonan-9-one
- IUPAC
- 2,4-bis(2-methoxyphenyl)-3-azabicyclo[3.3.1]nonan-9-one
Names & synonyms
2,4-bis(2-methoxyphenyl)-3-azabicyclo[3.3.1]nonan-9-one34143-13-0DTXSID603155862,4-Bis(2-methoxyphenyl)-3-azabicyclo(3.3.1)nonan-9-oneRefChem:245988DTXCID40266709NSC295524NSC-295524
Database identifiers
- CAS
34143-13-0- PubChem CID
- 325919
- DTXSID
DTXSID60315586
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 456
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Compound notes
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