2,4-Bis(4-methoxyphenyl)-3-methyl-3-azabicyclo[3.3.1]nonan-9-one
Basic information
- CAS
65712-58-5- Standard SMILES
COc1ccc(C2C3CCCC(C3=O)C(c3ccc(OC)cc3)N2C)cc1- InChIKey
OZBBTBNLYYBURZ-UHFFFAOYSA-N- Molecular formula
- C23H27NO3
- Average molar mass
- 365.5 g/mol
- Monoisotopic mass
- 365.19909372
Names & identifiers
- Preferred name
- 2,4-Bis(4-methoxyphenyl)-3-methyl-3-azabicyclo[3.3.1]nonan-9-one
- IUPAC
- 2,4-bis(4-methoxyphenyl)-3-methyl-3-azabicyclo[3.3.1]nonan-9-one
Names & synonyms
65712-58-5NSC2955282,4-bis(4-methoxyphenyl)-3-methyl-3-azabicyclo[3.3.1]nonan-9-oneDTXSID50315590NSC-295528
Database identifiers
- CAS
65712-58-5- PubChem CID
- 325923
- DTXSID
DTXSID50315590
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 466
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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