Bunamidine Hydrochloride
PubChem CID
13985
Structure
Molecular Formula
Synonyms
- Bunamidine hydrochloride
- 1055-55-6
- Scolaban
- Buban
- Bunamidine HCl
Molecular Weight
419.0 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Parent Compound
Component Compounds
Dates
- Create:2005-08-08
- Modify:2025-01-25
Chemical Structure Depiction
3D Conformer of Parent
N,N-dibutyl-4-hexoxynaphthalene-1-carboximidamide;hydrochloride
Computed by Lexichem TK 2.7.0 (PubChem release 2021.10.14)
InChI=1S/C25H38N2O.ClH/c1-4-7-10-13-20-28-24-17-16-23(21-14-11-12-15-22(21)24)25(26)27(18-8-5-2)19-9-6-3;/h11-12,14-17,26H,4-10,13,18-20H2,1-3H3;1H
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
PBYJDHRFPFHVKZ-UHFFFAOYSA-N
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
CCCCCCOC1=CC=C(C2=CC=CC=C21)C(=N)N(CCCC)CCCC.Cl
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C25H39ClN2O
Computed by PubChem 2.2 (PubChem release 2021.10.14)
1055-55-6
3748-77-4 (Parent)
- bunamidine
- bunamidine monohydrochloride
- N,N-dibutyl-4-(hexyloxy)-1-naphthamidine monohydrochloride
- Scolaban
- Bunamidine hydrochloride
- 1055-55-6
- Scolaban
- Buban
- Bunamidine HCl
- NSC-106571
- Bunamidine, monohydrochloride
- N,N-Dibutyl-4-(hexyloxy)naphthalene-1-carboximidamide hydrochloride
- EINECS 213-890-2
- Bunamidine hydrochloride [USAN]
- Bunamidine (hydrochloride)
- UNII-Y80LB0Q7CB
- Y80LB0Q7CB
- NSC 106571
- BW 62415
- DTXSID7046837
- N,N-Dibutyl-4-(hexyloxy)-1-naphthamidine monohydrochloride
- N,N-Dibutyl-4-hexyloxy-1-naphthamidine hydrochloride
- 1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, monohydrochloride
- DTXCID5026837
- N,N-dibutyl-4-hexoxynaphthalene-1-carboximidamide;hydrochloride
- 1-NAPHTHAMIDINE, N,N-DIBUTYL-4-HEXYLOXY-, MONOHYDROCHLORIDE
- 1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, hydrochloride
- NSC106571
- Bunamidine hydrochloride (USAN)
- BUNAMIDINE HYDROCHLORIDE (MART.)
- BUNAMIDINE HYDROCHLORIDE [MART.]
- NCGC00181091-01
- Scolaban 400
- SCHEMBL666727
- CHEMBL2104240
- PBYJDHRFPFHVKZ-UHFFFAOYSA-N
- EX-A5704
- Tox21_112707
- BUNAMIDINE HYDROCHLORIDE [MI]
- BW62415
- DA-71813
- MS-27334
- CAS-1055-55-6
- WLN: L66J BYUM&N4&4 EO6 &GH
- HY-145079
- BUNAMIDINE HYDROCHLORIDE [GREEN BOOK]
- CS-0343212
- NS00043107
- D03175
- Q27294366
- 1-Naphthamidine,N-dibutyl-4-hexyloxy-, monohydrochloride
- N,N-Dibutyl-4-(hexyloxy)-1-naphthamidine hydrochloride
- 1-Naphthamidine,N-dibutyl-4-(hexyloxy)-, monohydrochloride
- 1-Naphthalenecarboximidamide,N-dibutyl-4-(hexyloxy)-, monohydrochloride
- 1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, hydrochloride (1:1); Bunamidine Hydrochloride; 1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, monohydrochloride (9CI); 1-Naphthamidine, N,N-dibutyl-4-(hexyloxy)-, hydrochloride (7CI); 1-Na
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
419.0 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Donor Count
Property Value
2
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Rotatable Bond Count
Property Value
14
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Exact Mass
Property Value
418.2750916 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Monoisotopic Mass
Property Value
418.2750916 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Topological Polar Surface Area
Property Value
36.3 Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Heavy Atom Count
Property Value
29
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
417
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
2
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2021.10.14)
Active Ingredients (Bunamidine Hydrochloride) -> FDA Greenbook
Follow these links to do a live 2D search or do a live 3D search for this compound, sorted by annotation score. This section is deprecated (see here for details), but these live search links provide equivalent functionality to the table that was previously shown here.
Same Parent, Exact Count
Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
Same Count
Anthelmintics
Agents that kill parasitic worms. They are used therapeutically in the treatment of HELMINTHIASIS in man and animal. (See all compounds classified as Anthelmintics.)
Animal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients
Chemical Assessment
IMAP assessments - 1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, monohydrochloride: Environment tier I assessment
IMAP assessments - 1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, monohydrochloride: Human health tier I assessment
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=PBYJDHRFPFHVKZ-OQKDUQJOSA-N
- Australian Industrial Chemicals Introduction Scheme (AICIS)1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, monohydrochloridehttps://services.industrialchemicals.gov.au/search-assessments/
- CAS Common ChemistryLICENSEThe data from CAS Common Chemistry is provided under a CC-BY-NC 4.0 license, unless otherwise stated.https://creativecommons.org/licenses/by-nc/4.0/1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, hydrochloride (1:1)https://commonchemistry.cas.org/detail?cas_rn=1055-55-6
- ChemIDplusBunamidine hydrochloride [USAN]https://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0001055556ChemIDplus Chemical Information Classificationhttps://pubchem.ncbi.nlm.nih.gov/source/ChemIDplus
- DTP/NCILICENSEUnless otherwise indicated, all text within NCI products is free of copyright and may be reused without our permission. Credit the National Cancer Institute as the source.https://www.cancer.gov/policies/copyright-reuse
- EPA DSSToxBunamidine hydrochloridehttps://comptox.epa.gov/dashboard/DTXSID7046837CompTox Chemicals Dashboard Chemical Listshttps://comptox.epa.gov/dashboard/chemical-lists/
- European Chemicals Agency (ECHA)LICENSEUse of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: "Source: European Chemicals Agency, http://echa.europa.eu/". Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.https://echa.europa.eu/web/guest/legal-noticeN,N-dibutyl-4-(hexyloxy)naphthalene-1-carboximidamide hydrochloridehttps://echa.europa.eu/substance-information/-/substanceinfo/100.012.628
- FDA Global Substance Registration System (GSRS)LICENSEUnless otherwise noted, the contents of the FDA website (www.fda.gov), both text and graphics, are not copyrighted. They are in the public domain and may be republished, reprinted and otherwise used freely by anyone without the need to obtain permission from FDA. Credit to the U.S. Food and Drug Administration as the source is appreciated but not required.https://www.fda.gov/about-fda/about-website/website-policies#linkingBUNAMIDINE HYDROCHLORIDEhttps://gsrs.ncats.nih.gov/ginas/app/beta/substances/Y80LB0Q7CB
- ChEMBLLICENSEAccess to the web interface of ChEMBL is made under the EBI's Terms of Use (http://www.ebi.ac.uk/Information/termsofuse.html). The ChEMBL data is made available on a Creative Commons Attribution-Share Alike 3.0 Unported License (http://creativecommons.org/licenses/by-sa/3.0/).http://www.ebi.ac.uk/Information/termsofuse.html
- Drug Gene Interaction database (DGIdb)LICENSEThe data used in DGIdb is all open access and where possible made available as raw data dumps in the downloads section.http://www.dgidb.org/downloadsBUNAMIDINE HYDROCHLORIDEhttps://www.dgidb.org/drugs/ncit:C75211
- FDA Approved Animal Drug Products (Green Book)LICENSEUnless otherwise noted, the contents of the FDA website (www.fda.gov), both text and graphics, are not copyrighted. They are in the public domain and may be republished, reprinted and otherwise used freely by anyone without the need to obtain permission from FDA. Credit to the U.S. Food and Drug Administration as the source is appreciated but not required.https://www.fda.gov/about-fda/about-website/website-policies#linkingBunamidine Hydrochloridehttps://www.fda.gov/animal-veterinary/products/approved-animal-drug-products-green-book
- KEGGLICENSEAcademic users may freely use the KEGG website. Non-academic use of KEGG generally requires a commercial licensehttps://www.kegg.jp/kegg/legal.html
- NCI Thesaurus (NCIt)LICENSEUnless otherwise indicated, all text within NCI products is free of copyright and may be reused without our permission. Credit the National Cancer Institute as the source.https://www.cancer.gov/policies/copyright-reuseNCI Thesaurushttps://ncit.nci.nih.gov
- Springer Nature
- Wikidatabunamidine hydrochloridehttps://www.wikidata.org/wiki/Q27294366
- PubChem
- Medical Subject Headings (MeSH)LICENSEWorks produced by the U.S. government are not subject to copyright protection in the United States. Any such works found on National Library of Medicine (NLM) Web sites may be freely used or reproduced without permission in the U.S.https://www.nlm.nih.gov/copyright.htmlAnthelminticshttps://www.ncbi.nlm.nih.gov/mesh/68000871
- NORMAN Suspect List ExchangeLICENSEData: CC-BY 4.0; Code (hosted by ECI, LCSB): Artistic-2.0https://creativecommons.org/licenses/by/4.0/NORMAN Suspect List Exchange Classificationhttps://www.norman-network.com/nds/SLE/
- EPA Substance Registry ServicesEPA SRS List Classificationhttps://sor.epa.gov/sor_internet/registry/substreg/LandingPage.do
- MolGenieMolGenie Organic Chemistry Ontologyhttps://github.com/MolGenie/ontology/
- PATENTSCOPE (WIPO)SID 389158345https://pubchem.ncbi.nlm.nih.gov/substance/389158345
CONTENTS