Vitas-M small molecule compound

8-[4-(2-chlorophenyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STL150843
SMILES CC(=C)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)c1ccccc1Cl

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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 C20H23ClN6O2 MW 414.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN6O2/c1-13(2)12-27-16-17(24(3)20(29)23-18(16)28)22-19(27)26-10-8-25(9-11-26)15-7-5-4-6-14(15)21/h4-7H,1,8-12H2,2-3H3,(H,23,28,29)
InChIKey
NECPIOYHCYWHSX-UHFFFAOYSA-N
Synonyms
497248-17-6
497248176
8(4(2CHLOROPHENYL)PIPERAZIN1YL)3METHYL7(2METHYLPROP2ENYL)PURINE26DIONE
8(4(2chlorophenyl)piperazin1yl)6hydroxy3methyl7(2methylprop2en1yl)37dihydro2Hpurin2one
8(4(2CHLOROPHENYL)PIPERAZINYL)3METHYL7(2METHYLPROP2ENYL)137TRIHYDROPURINE26DIONE
CC(=C)CN1C2=C(N=C1N3CCN(CC3)C4=CC=CC=C4Cl)N(C(=O)NC2=O)C
InChI=1SC20H23ClN6O2c113(2)12271617(24(3)20(29)2318(16)28)2219(27)2610825(91126)15754614(15)21h47H1812H223H3(H232829)
MFCD03796581
ZINC000000634484
ZINC00634484
ZINC634484

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Available files

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