1-(4-Methoxyphenyl)-4-(p-tolylsulphonyl)piperazine
Basic information
- CAS
83863-43-8- Standard SMILES
COc1ccc(N2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1- InChIKey
AFCUSINUINYQAT-UHFFFAOYSA-N- Molecular formula
- C18H22N2O3S
- Average molar mass
- 346.4 g/mol
- Monoisotopic mass
- 346.13511374
Names & identifiers
- Preferred name
- 1-(4-Methoxyphenyl)-4-(p-tolylsulphonyl)piperazine
- IUPAC
- 1-(4-methoxyphenyl)-4-(4-methylphenyl)sulfonylpiperazine
- English name
- 1-(4-methoxyphenyl)-4-(p-tolylsulphonyl)piperazine
- Molecular formula
- C18H22N2O3S
- Molecular weight
- 346.44
Names & synonyms
83863-43-81-(4-methoxyphenyl)-4-[(4-methylphenyl)sulfonyl]piperazine1-(4-Methoxyphenyl)-4-(p-tolylsulphonyl)piperazineEINECS 281-106-61-(4-methoxyphenyl)-4-(4-methylphenyl)sulfonylpiperazine1-(4-methoxyphenyl)-4-(p-tolylsulfonyl)piperazineTR9BZU569HOprea1_443855AFCUSINUINYQAT-UHFFFAOYSA-NDTXSID701003969STL259409AKOS000383152
Show more names
NS000607891-(4-Methoxyphenyl)-4-(4-methylbenzene-1-sulfonyl)piperazinePiperazine, 1-(4-methoxyphenyl)-4-[(4-methylphenyl)sulfonyl]-
Database identifiers
- CAS
83863-43-8- PubChem CID
- 798545
- DTXSID
DTXSID701003969- UNII
- TR9BZU569H
- EC Number
- 281-106-6
- Nikkaji
- J326.927B
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 481
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Compound notes
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