Basic information
- CAS
918479-67-1- Standard SMILES
CC(Oc1ccccc1)C(=O)N1CCN(C(C)c2ccccc2)CC1- InChIKey
RCGHADCFEXHEMO-UHFFFAOYSA-N- Molecular formula
- C21H26N2O2
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.19942808
Names & identifiers
- Preferred name
- 2-Phenoxy-1-[4-(1-phenylethyl)piperazin-1-yl]propan-1-one
- IUPAC
- 2-phenoxy-1-[4-(1-phenylethyl)piperazin-1-yl]propan-1-one
Names & synonyms
918479-67-12-Phenoxy-1-[4-(1-phenylethyl)piperazin-1-yl]propan-1-oneSCHEMBL13149425DTXSID30672971
Database identifiers
- CAS
918479-67-1- PubChem CID
- 46100725
- DTXSID
DTXSID30672971
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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