CHEBI:123115 - diaveridine

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ChEBI Name diaveridine ChEBI ID CHEBI:123115 Definition An aminopyrimidine in which the pyrimidine ring carries amino substituents at C-2 and C-4 and a 3,4-dimethoxybenzyl group at C-5. A folic acid antagonist, it is used as a synergist with sulfonamides against the parasitic Eimeria species. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C13H16N4O2 Net Charge 0 Average Mass 260.29170 Monoisotopic Mass 260.12733 InChI InChI=1S/C13H16N4O2/c1-18-10-4-3-8(6-11(10)19-2)5-9-7-16-13(15)17-12(9)14/h3-4,6-7H,5H2,1-2H3,(H4,14,15,16,17) InChIKey LDBTVAXGKYIFHO-UHFFFAOYSA-N SMILES COc1ccc(Cc2cnc(N)nc2N)cc1OC Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Biological Role(s): drug allergen Any drug which causes the onset of an allergic reaction. Application(s): antiparasitic agent A substance used to treat or prevent parasitic infections. drug allergen Any drug which causes the onset of an allergic reaction. View more via ChEBI Ontology ChEBI Ontology Outgoing diaveridine (CHEBI:123115) has role antiparasitic agent (CHEBI:35442) diaveridine (CHEBI:123115) has role drug allergen (CHEBI:88188) diaveridine (CHEBI:123115) is a aminopyrimidine (CHEBI:38338) IUPAC Name 5-(3,4-dimethoxybenzyl)pyrimidine-2,4-diamine INNs Sources diaveridina ChemIDplus diaveridine ChemIDplus diaveridinum ChemIDplus Synonyms Sources 2,4-Diamino-5-(3,4-dimethoxybenzyl)pyrimidine ChemIDplus 2,4-Diamino-5-veratrylpyrimidine ChemIDplus 5-((3,4-Dimethoxyphenyl)methyl)-2,4-pyrimidinediamine ChemIDplus 5-(3,4-Dimethoxy-benzyl)-pyrimidine-2,4-diamine ChEMBL Diaveridin ChemIDplus Manual Xrefs Databases D03771 KEGG DRUG US2624732 Patent US3341541 Patent View more database links Registry Numbers Types Sources 0258464 Beilstein Registry Number Beilstein 258464 Reaxys Registry Number Reaxys 5355-16-8 CAS Registry Number KEGG DRUG 5355-16-8 CAS Registry Number ChemIDplus Citations Types Sources 21781790 PubMed citation Europe PMC 2327254 PubMed citation Europe PMC 24999617 PubMed citation Europe PMC 3377143 PubMed citation Europe PMC 4982548 PubMed citation Europe PMC 8911701 PubMed citation Europe PMC Last Modified 04 March 2019