CHEBI:189531 - ICR 340

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ICR 340
ChEBI ID CHEBI:189531
Definition The dihydrochloride salt of ICR 340.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
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Formula C20H24Cl2N4O.ClH.ClH
Net Charge 0
Average Mass 480.260
Monoisotopic Mass 478.08607
InChI InChI=1S/C20H24Cl2N4O.2ClH/c1-3-26(12-9-21)11-4-10-23-19-15-6-5-14(22)13-17(15)24-16-7-8-18(27-2)25-20(16)19;;/h5-8,13H,3-4,9-12H2,1-2H3,(H,23,24);2*1H
InChIKey PUURHJFGPZZDJF-UHFFFAOYSA-N
SMILES Cl.Cl.CCN(CCCl)CCCNC1=C2N=C(OC)C=CC2=NC2=C1C=CC(Cl)=C2
Roles Classification
Biological Role(s): mutagen
An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.
carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ICR 340 (CHEBI:189531) has part ICR 340(2+) (CHEBI:189545)
ICR 340 (CHEBI:189531) has role carcinogenic agent (CHEBI:50903)
ICR 340 (CHEBI:189531) has role mutagen (CHEBI:25435)
ICR 340 (CHEBI:189531) is a hydrochloride (CHEBI:36807)
IUPAC Name
N-(2-chloroethyl)-N'-(7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-yl)-N-ethylpropane-1,3-diamine dihydrochloride
Synonyms Sources
ICR 340 dihydrochloride ChEBI
ICR-340 ChEBI
ICR-340 dihydrochloride ChEBI
N1-(2-chloroethyl)-N3-(7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-yl)-N1-ethylpropane-1,3-diamine—hydrogen chloride (1/2) IUPAC
Manual Xref Database
4514643 ChemSpider
View more database links
Registry Number Type Source
38915-28-5 CAS Registry Number ChemIDplus
Citations Types Sources
4548187 PubMed citation Europe PMC
91429 PubMed citation Europe PMC
Last Modified
26 January 2022