Vitas-M small molecule compound
8-(cyclohexylamino)-1,3-dimethyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840634
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CCc1ccccc1)c(n2)NC1CCCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H27N5O2 MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2/c1-24-18-17(19(27)25(2)21(24)28)26(14-13-15-9-5-3-6-10-15)20(23-18)22-16-11-7-4-8-12-16/h3,5-6,9-10,16H,4,7-8,11-14H2,1-2H3,(H,22,23)InChIKey
BXSYBDDSTLZOKM-UHFFFAOYSA-NSynonyms
8(cyclohexylamino)13dimethyl7(2phenylethyl)37dihydro1Hpurine26dione
8(cyclohexylamino)13dimethyl7(2phenylethyl)purine26dione
8(cyclohexylamino)13dimethyl7phenethyl1Hpurine26(3H7H)dione
8(CYCLOHEXYLAMINO)13DIMETHYL7PHENETHYLPURINE26DIONE
8CYCLOHEXYLAMINO13DIMETHYL7PHENETHYL37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NC3CCCCC3)CCC4=CC=CC=C4
InChI=1SC21H27N5O2c1241817(19(27)25(2)21(24)28)26(14131595361015)20(2318)2216117481216h35691016H4781114H212H3(H2223)
MFCD02237392
ZINC000000625671
ZINC00625671
ZINC625671
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