Basic information
- CAS
83863-40-5- Standard SMILES
Cc1ccc(S(=O)(=O)N2CCC(O)(c3ccccc3)CC2)cc1- InChIKey
HXIDISDSNWNESD-UHFFFAOYSA-N- Molecular formula
- C18H21NO3S
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.12421471
Names & identifiers
- Preferred name
- 4-Phenyl-1-(p-tolylsulphonyl)piperidin-4-ol
- IUPAC
- 1-(4-methylphenyl)sulfonyl-4-phenylpiperidin-4-ol
- English name
- 4-phenyl-1-(p-tolylsulphonyl)piperidin-4-ol
- Molecular formula
- C18H21NO3S
- Molecular weight
- 331.42924
Names & synonyms
83863-40-54-Phenyl-1-(p-tolylsulphonyl)piperidin-4-olEINECS 281-102-4NSC163342DTXSID10232754HXIDISDSNWNESD-UHFFFAOYSA-NNSC 163342NSC-163342NS000383361-(4-Methylbenzene-1-sulfonyl)-4-phenylpiperidin-4-ol1-(4-methylphenyl)sulfonyl-4-phenylpiperidin-4-ol1-[(4-Methylphenyl)sulfonyl]-4-phenyl-4-piperidinol
Database identifiers
- CAS
83863-40-5- PubChem CID
- 98752
- DTXSID
DTXSID10232754- EC Number
- 281-102-4
- Nikkaji
- J326.924H
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 477
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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