Vitas-M small molecule compound
7-hexyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK539293
SMILES CCCCCCn1c(NCc2ccc(cc2)C)nc2c1c(=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/c1-4-5-6-7-12-25-16-17(24(3)20(27)23-18(16)26)22-19(25)21-13-15-10-8-14(2)9-11-15/h8-11H,4-7,12-13H2,1-3H3,(H,21,22)(H,23,26,27)InChIKey
KUUQNKBFHUALLN-UHFFFAOYSA-NSynonyms
329702-61-6329702616
7HEXYL3METHYL8(((4METHYLPHENYL)METHYL)AMINO)137TRIHYDROPURINE26DIONE
7hexyl3methyl8((4methylbenzyl)amino)1Hpurine26(3H7H)dione
7hexyl3methyl8((4methylbenzyl)amino)37dihydro1Hpurine26dione
7HEXYL3METHYL8((4METHYLPHENYL)METHYLAMINO)PURINE26DIONE
7HEXYL3METHYL8(4METHYLBENZYLAMINO)37DIHYDROPURINE26DIONE
CCCCCCn1c(NCc2ccc(cc2)C)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCN1C2=C(N=C1NCC3=CC=C(C=C3)C)N(C(=O)NC2=O)C
InChI=1SC20H27N5O2c1456712251617(24(3)20(27)2318(16)26)2219(25)21131510814(2)91115h811H471213H213H3(H2122)(H232627)
MFCD02170835
ZINC000012437182
ZINC12437182
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