Vitas-M small molecule compound

2-{4-[6-hydroxy-3-methyl-2-oxo-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-8-yl]piperazin-1-yl}acetamide

Catalog ID
STK586343
SMILES NC(=O)CN1CCN(CC1)c1nc2c(n1CCCc1ccccc1)c(O)nc(=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 C21H27N7O3 MW 425.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N7O3/c1-25-18-17(19(30)24-21(25)31)28(9-5-8-15-6-3-2-4-7-15)20(23-18)27-12-10-26(11-13-27)14-16(22)29/h2-4,6-7H,5,8-14H2,1H3,(H2,22,29)(H,24,30,31)
InChIKey
ZAHRUSHTXKQRCP-UHFFFAOYSA-N
Synonyms
895842-23-6
2(4(3METHYL26DIOXO7(3PHENYLPROPYL)137TRIHYDROPURIN8YL)PIPERAZINYL)ACETAMIDE
2(4(3METHYL26DIOXO7(3PHENYLPROPYL)PURIN8YL)PIPERAZIN1YL)ACETAMIDE
2(4(6hydroxy3methyl2oxo7(3phenylpropyl)37dihydro2Hpurin8yl)piperazin1yl)acetamide
895842236
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)CC(=O)N)CCCC4=CC=CC=C4
InChI=1SC21H27N7O3c1251817(19(30)2421(25)31)28(958156324715)20(2318)27121026(111327)1416(22)29h2467H5814H21H3(H22229)(H243031)
MFCD08735346
ZINC000056952841
ZINC56952841

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Available files

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