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1-(4-Nitrophenyl)sulfonyl-4-phenylpiperazine

HCID 768437
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Basic information

CAS
346691-54-1
Standard SMILES
O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1
InChIKey
XODLTOYHPDBTRW-UHFFFAOYSA-N
Molecular formula
C16H17N3O4S
Average molar mass
347.4 g/mol
Monoisotopic mass
347.09397721

Names & identifiers

Preferred name
1-(4-Nitrophenyl)sulfonyl-4-phenylpiperazine
IUPAC
1-(4-nitrophenyl)sulfonyl-4-phenylpiperazine

Names & synonyms

1-(4-nitrophenyl)sulfonyl-4-phenylpiperazine346691-54-1Cambridge id 53555121-[(4-nitrophenyl)sulfonyl]-4-phenylpiperazineOprea1_303807Oprea1_563290orb3172998SCHEMBL1711126NSC781052AKOS003235549NSC-781052ST50694764
Show more names
AB00082604-011-(4-nitrobenzene-1-sulfonyl)-4-phenylpiperazine4-nitro-1-[(4-phenylpiperazinyl)sulfonyl]benzene

Database identifiers

CAS
346691-54-1
PubChem CID
768437

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
94.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
24
Formal charge
0
Complexity
521

Related reactions

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Compound notes

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