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Cycloguanil-[d4] Hydrochloride

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General Information
Catalog: BLP-012283
CAS: 1189427-23-3
Molecular Formula: C11H11D4Cl2N5
Molecular Weight: 292.2

Chemical Structure

Description	Cycloguanil-[d4] Hydrochloride is a labelled analogue of Cycloguanil. Cycloguanidine is a dihydrofolate reductase inhibitor and a metabolite of the antimalarial drug proguanil.
Synonyms	Cycloguanil-d4 Hydrochloride
IUPAC Name	1-(4-chloro-2,3,5,6-tetradeuteriophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine;hydrochloride
Related CAS	152-53-4 (unlabelled)
Canonical SMILES	CC1(N=C(N=C(N1C2=CC=C(C=C2)Cl)N)N)C.Cl
InChI	InChI=1S/C11H14ClN5.ClH/c1-11(2)16-9(13)15-10(14)17(11)8-5-3-7(12)4-6-8;/h3-6H,1-2H3,(H4,13,14,15,16);1H/i3D,4D,5D,6D;
InChI Key	MOUAPRKJJUXEIE-HGSONKNXSA-N
Melting Point	203-205°C
Purity	98% by HPLC; 98% atom D
Solubility	Soluble in DMSO, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C