8-(4-Methyl-piperazin-1-yl)-3phenylsulfonylquinoline

HCID 9929162
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Basic information

CAS
607742-54-1
Standard SMILES
CN1CCN(c2cccc3cc(S(=O)(=O)c4ccccc4)cnc23)CC1
InChIKey
XQFZXGMXIGWTFC-UHFFFAOYSA-N
Molecular formula
C20H21N3O2S
Average molar mass
367.5 g/mol
Monoisotopic mass
367.13544791

Names & identifiers

Preferred name
8-(4-Methyl-piperazin-1-yl)-3phenylsulfonylquinoline
IUPAC
3-(benzenesulfonyl)-8-(4-methylpiperazin-1-yl)quinoline

Names & synonyms

8-(4-Methyl-piperazin-1-yl)-3phenylsulfonylquinoline607742-54-13-(benzenesulfonyl)-8-(4-methylpiperazin-1-yl)quinolineSCHEMBL2197288DTXSID70432995XQFZXGMXIGWTFC-UHFFFAOYSA-N8-(4-Methyl-piperazin-1-yl)-3-phenylsulfonylquinoline

Database identifiers

CAS
607742-54-1
PubChem CID
9929162
DTXSID
DTXSID70432995

Properties

Computed structural propertiesFilling in

XLogP
2.9
Topological polar surface area
61.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
26

Related reactions

24 records
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Compound notes

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