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CHEBI:52082 - pibenzimol

ChEBI IDCHEBI:52082
ChEBI Namepibenzimol
Stars
Last Modified6 March 2009
SubmitterInma Spiteri
DownloadsMolfile
FormulaC25H24N6O
Net Charge0
Average Mass424.508
Monoisotopic Mass424.20116
SMILESCN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)cc6)nc5c4)nc3c2)CC1
InChIInChI=1S/C25H24N6O/c1-30-10-12-31(13-11-30)18-5-9-21-23(15-18)29-25(27-21)17-4-8-20-22(14-17)28-24(26-20)16-2-6-19(32)7-3-16/h2-9,14-15,32H,10-13H2,1H3,(H,26,28)(H,27,29)
InChIKeyINAAIJLSXJJHOZ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Applications:
anthelminthic drug  Substance intended to kill parasitic worms (helminths).
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
pibenzimol (CHEBI:52082) has role anthelminthic drug (CHEBI:35443)
pibenzimol (CHEBI:52082) has role fluorochrome (CHEBI:51217)
pibenzimol (CHEBI:52082) is a N-methylpiperazine (CHEBI:46920)
pibenzimol (CHEBI:52082) is a bibenzimidazole (CHEBI:46884)
Incoming Relation(s)
2'-(4-ethoxyphenyl)-5-(4-methylpiperazin-1-yl)-2,5'-bibenzimidazole (CHEBI:51232) has functional parent pibenzimol (CHEBI:52082)
IUPAC Name 
4-[5-(4-methylpiperazin-1-yl)-1H,1'H-2,5'-bibenzimidazol-2'-yl]phenol
Synonyms  Source
4-(5-(4-Methyl-1-piperazinyl)(2,5'-bi-1H-benzimidazol)-2'-yl)phenolChemIDplus
BisbenzimidazoleChemIDplus
Hoe-33258ChemIDplus
HOECHST 33258ChEBI
p-(5-(5-(4-Methyl-1-piperazinyl)-2-benzimidazolyl)-2-benzimidazolyl)phenolChemIDplus
Registry NumbersSources
Beilstein:6355761Beilstein
CAS:23491-44-3ChemIDplus