1-[4-(4-Fluorophenyl)piperazin-1-yl]sulfonylazepane
Basic information
- CAS
728031-43-4- Standard SMILES
O=S(=O)(N1CCCCCC1)N1CCN(c2ccc(F)cc2)CC1- InChIKey
JTMNPAIQUAAVIL-UHFFFAOYSA-N- Molecular formula
- C16H24FN3O2S
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- 1-[4-(4-Fluorophenyl)piperazin-1-yl]sulfonylazepane
- IUPAC
- 1-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylazepane
- English name
- 1-{[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl}azepane
- Molecular formula
- C16H24FN3O2S
- Molecular weight
- 341.4440632
Names & synonyms
1-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylazepane728031-43-41-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}azepaneSTK782171AKOS002567585ST4120429AP-124/433828471-{[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl}azepaneZ2238261361-(azaperhydroepinylsulfonyl)-4-(4-fluorophenyl)piperazine1-{[4-(4-FLUOROPHENYL)PIPERAZINO]SULFONYL}AZEPANE
Database identifiers
- CAS
728031-43-4
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 52.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 458
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Compound notes
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