Vitas-M small molecule compound
8-(cyclohexylamino)-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK838411
SMILES Cc1cccc(c1)Cn1c(NC2CCCCC2)nc2c1c(=O)n(c(=O)n2C)C
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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/c1-14-8-7-9-15(12-14)13-26-17-18(24(2)21(28)25(3)19(17)27)23-20(26)22-16-10-5-4-6-11-16/h7-9,12,16H,4-6,10-11,13H2,1-3H3,(H,22,23)InChIKey
DNWBPKBVPMRGAY-UHFFFAOYSA-NSynonyms
359901-51-2359901512
8(CYCLOHEXYLAMINO)13DIMETHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8(CYCLOHEXYLAMINO)13DIMETHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8(CYCLOHEXYLAMINO)13DIMETHYL7(3METHYLBENZYL)1HPURINE26(3H7H)DIONE
8(cyclohexylamino)13dimethyl7(3methylbenzyl)37dihydro1Hpurine26dione
8CYCLOHEXYLAMINO13DIMETHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2NC4CCCCC4)N(C(=O)N(C3=O)C)C
InChI=1SC21H27N5O2c11487915(1214)13261718(24(2)21(28)25(3)19(17)27)2320(26)2216105461116h791216H46101113H213H3(H2223)
MFCD02735458
ZINC000000629087
ZINC00629087
ZINC629087
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