Bicyclo(3.3.1)nonan-9-one, 1-phenyl-4-(4-phenyl-1-piperazinyl)-, monohydrochloride
Basic information
- CAS
36489-45-9- Standard SMILES
Cl.O=C1C2CCCC1(c1ccccc1)CCC2N1CCN(c2ccccc2)CC1- InChIKey
BOTADDMHRIPLAK-UHFFFAOYSA-N- Molecular formula
- C25H31ClN2O
- Average molar mass
- 411 g/mol
- Monoisotopic mass
- 410.2124913
Names & identifiers
- Preferred name
- Bicyclo(3.3.1)nonan-9-one, 1-phenyl-4-(4-phenyl-1-piperazinyl)-, monohydrochloride
- IUPAC
- 1-phenyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one;hydrochloride
Names & synonyms
36489-45-92-(4-Phenyl-1-piperazinyl)-5-phenylbicyclo(3.3.1)nonan-9-one hydrochloride1-Phenyl-4-(4-phenyl-1-piperazinyl)bicyclo(3.3.1)nonan-9-one hydrochlorideBicyclo(3.3.1)nonan-9-one, 1-phenyl-4-(4-phenyl-1-piperazinyl)-, monohydrochlorideRefChem:329362DTXSID509577971-Phenyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one--hydrogen chloride (1/1)
Database identifiers
- CAS
36489-45-9- PubChem CID
- 215857
- DTXSID
DTXSID50957797
Properties
Computed structural properties
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 543
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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