FURODAZOLE

ID: ALA2104697

Chembl Id: CHEMBL2104697

Cas Number: 56119-96-1

PubChem CID: 312914

Max Phase: Phase

Molecular Formula: C15H11N3O2

Molecular Weight: 265.27

Molecule Type: Small molecule

Associated Items:

Names and Identifiers

Synonyms: Furodazole anhydrous | Furodazole, anhydrous | F-691 | NSC-225227 | Furodazole|56119-96-1|Furodazole [INN]|Furodazole anhydrous|UNII-5B6I19ZE0R|5B6I19ZE0R|Furodazole, anhydrous|NSC 225227|NSC-225227|2-(furan-2-yl)-7-methyl-3,6-dihydroimidazo[4,5-f]quinolin-9-one|1H-Imidazo(4,5-f)quinolin-9-ol, 2-(2-furanyl)-7-methyl-|Furodazole (USAN/INN)|F 691|CHEMBL2104697|SCHEMBL10753539|SCHEMBL17786394|DTXSID00204662|NYRSQWAKUMYFLI-UHFFFAOYSA-N|NSC225227|NS00121712|D04278|Q27261785|2-(2-Furyl)-7-methyl-1H-imShow More

Canonical SMILES:  Cc1cc(O)c2c(ccc3nc(-c4ccco4)[nH]c32)n1

Standard InChI:  InChI=1S/C15H11N3O2/c1-8-7-11(19)13-9(16-8)4-5-10-14(13)18-15(17-10)12-3-2-6-20-12/h2-7H,1H3,(H,16,19)(H,17,18)

Standard InChI Key:  NYRSQWAKUMYFLI-UHFFFAOYSA-N

Alternative Forms

  1. Parent:

    ALA2104697

    FURODAZOLE

Associated Targets(non-human)

Rodentolepis nana (555 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Taenia pisiformis (10 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Canis familiaris (36305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Taenia crassiceps (97 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Molecule Features

Natural Product: NoOral: NoChemical Probe: NoParenteral: No
Molecule Type: Small moleculeTopical: NoFirst In Class: NoBlack Box: No
Chirality: YesAvailability: NoProdrug: No

Drug Indications

MESH IDMESH Heading EFO IDsEFO TermsMax Phase for IndicationReferences

Mechanisms of Action

Mechanism of ActionAction Typetarget IDTarget NameTarget TypeTarget OrganismBinding Site NameReferences

Calculated Properties

Molecular Weight: 265.27Molecular Weight (Monoisotopic): 265.0851AlogP: 3.39#Rotatable Bonds: 1
Polar Surface Area: 74.94Molecular Species: NEUTRALHBA: 4HBD: 2
#RO5 Violations: HBA (Lipinski): 5HBD (Lipinski): 2#RO5 Violations (Lipinski):
CX Acidic pKa: 9.11CX Basic pKa: 3.85CX LogP: 2.33CX LogD: 2.32
Aromatic Rings: 4Heavy Atoms: 20QED Weighted: 0.55Np Likeness Score: -0.70

References

1. USP Dictionary of USAN and International Names (2010 edition) and USAN registrations 2007-date, 
2. Alaimo RJ, Spencer CF, Sheffer JB, Storrin RJ, Hatton CJ, Kohls RE..  (1978)  Imidazo[4,5-f]quinolines. 4. Synthesis and anthelmintic activity of a series of imidazo[4,5-f]quinolin-9-ols.,  21  (3): [PMID:564407] [10.1021/jm00201a014]