Vitas-M small molecule compound
8-(hexylamino)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840175
SMILES CCCCCCNc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C
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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 C20H27N5O2 MW 369.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O2/c1-4-5-6-7-11-21-19-22-17-16(18(26)23-20(27)24(17)3)25(19)13-15-10-8-9-14(2)12-15/h8-10,12H,4-7,11,13H2,1-3H3,(H,21,22)(H,23,26,27)InChIKey
MGQLPZBNIHMZHB-UHFFFAOYSA-NSynonyms
378211-94-0378211940
8(HEXYLAMINO)3METHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8(HEXYLAMINO)3METHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8(hexylamino)3methyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8(hexylamino)3methyl7(3methylbenzyl)37dihydro1Hpurine26dione
8HEXYLAMINO3METHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
CCCCCCNC1=NC2=C(N1CC3=CC=CC(=C3)C)C(=O)NC(=O)N2C
CCCCCCNc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C
InChI=1SC20H27N5O2c14567112119221716(18(26)2320(27)24(17)3)25(19)1315108914(2)1215h81012H471113H213H3(H2122)(H232627)
MFCD02984561
ZINC000012647661
ZINC12647661
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