4-(Diphenylmethylidene)-1-(4-methylbenzene-1-sulfonyl)piperidine
Basic information
- CAS
916976-33-5- Standard SMILES
Cc1ccc(S(=O)(=O)N2CCC(=C(c3ccccc3)c3ccccc3)CC2)cc1- InChIKey
HZVPVNVZLGEGLT-UHFFFAOYSA-N- Molecular formula
- C25H25NO2S
- Average molar mass
- 403.5 g/mol
- Monoisotopic mass
- 403.16060021
Names & identifiers
- Preferred name
- 4-(Diphenylmethylidene)-1-(4-methylbenzene-1-sulfonyl)piperidine
- IUPAC
- 4-benzhydrylidene-1-(4-methylphenyl)sulfonylpiperidine
Names & synonyms
916976-33-5DTXSID506488704-(Diphenylmethylidene)-1-(4-methylbenzene-1-sulfonyl)piperidineRefChem:288938DTXCID40599620
Database identifiers
- CAS
916976-33-5- PubChem CID
- 25147239
- DTXSID
DTXSID50648870- Nikkaji
- J2.386.093G
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 627
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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