Vitas-M small molecule compound

8-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-dimethyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL002319
SMILES CCCCCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccc(cc1)OC

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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 C23H32N6O3 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N6O3/c1-5-6-7-12-29-19-20(25(2)23(31)26(3)21(19)30)24-22(29)28-15-13-27(14-16-28)17-8-10-18(32-4)11-9-17/h8-11H,5-7,12-16H2,1-4H3
InChIKey
PTIWWJPILBRZMJ-UHFFFAOYSA-N
Synonyms
845903-50-6
8(4(4methoxyphenyl)piperazin1yl)13dimethyl7pentyl1Hpurine26(3H7H)dione
8(4(4methoxyphenyl)piperazin1yl)13dimethyl7pentyl37dihydro1Hpurine26dione
8(4(4METHOXYPHENYL)PIPERAZIN1YL)13DIMETHYL7PENTYLPURINE26DIONE
8(4(4METHOXYPHENYL)PIPERAZINYL)13DIMETHYL7PENTYL137TRIHYDROPURINE26DIONE
845903506
CCCCCN1C2=C(N=C1N3CCN(CC3)C4=CC=C(C=C4)OC)N(C(=O)N(C2=O)C)C
InChI=1SC23H32N6O3c156712291920(25(2)23(31)26(3)21(19)30)2422(29)28151327(141628)1781018(324)11917h811H571216H214H3
MFCD04173298
ZINC000009001556
ZINC09001556
ZINC9001556

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Available files

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