1-[(4-Bromophenyl)sulfonyl]-4-phenylpiperazine

HCID 259481

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Basic information

CAS: 324777-56-2
Standard SMILES: O=S(=O)(c1ccc(Br)cc1)N1CCN(c2ccccc2)CC1
InChIKey: QGXNVCFMUCORAL-UHFFFAOYSA-N
Molecular formula: C16H17BrN2O2S
Average molar mass: 381.3 g/mol
Monoisotopic mass: 380.01941

Names & identifiers

Preferred name: 1-[(4-Bromophenyl)sulfonyl]-4-phenylpiperazine
IUPAC: 1-(4-bromophenyl)sulfonyl-4-phenylpiperazine

Names & synonyms

1-[(4-bromophenyl)sulfonyl]-4-phenylpiperazine324777-56-21-(4-Bromobenzene-1-sulfonyl)-4-phenylpiperazine1-(4-bromophenyl)sulfonyl-4-phenylpiperazine1-(4-Bromo-benzenesulfonyl)-4-phenyl-piperazineNSC89446CBMicro_005475NCIOpen2_009779Oprea1_123690Oprea1_432971MLS001211023SCHEMBL2836518

Show more names

CHEMBL1350065DTXSID401248667HMS2819D19SMSF0006384NSC-89446STK158659AKOS000595585CB07561

Database identifiers

CAS: 324777-56-2
PubChem CID: 259481
DTXSID: DTXSID401248667
ChEMBL: CHEMBL1350065

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 49 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 22
Formal charge: 0
Complexity: 443

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