Basic information
- CAS
5435-08-5- Standard SMILES
O=S(=O)(c1ccccc1)N1CCCCC1CCc1ccccc1- InChIKey
IOYVSZINQXDJEV-UHFFFAOYSA-N- Molecular formula
- C19H23NO2S
- Average molar mass
- 329.5 g/mol
- Monoisotopic mass
- 329.14495015
Names & identifiers
- Preferred name
- 1-(Benzenesulfonyl)-2-phenethylpiperidine
- IUPAC
- 1-(benzenesulfonyl)-2-(2-phenylethyl)piperidine
Names & synonyms
5435-08-5MLS0026384161-(benzenesulfonyl)-2-phenethylpiperidineNSC151741-(phenylsulfonyl)-2-phenethylpiperidinePiperidine,2-(2-phenylethyl)-1-(phenylsulfonyl)-CHEMBL1733323SCHEMBL22633422DTXSID20280049HMS3089J04NSC-15174SMR001547897
Show more names
DS-0122521-(benzenesulfonyl)-2-(2-phenylethyl)piperidine
Database identifiers
- CAS
5435-08-5- PubChem CID
- 225601
- DTXSID
DTXSID20280049- ChEMBL
CHEMBL1733323
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 444
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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