Vitas-M small molecule compound

8-(4-benzylpiperidin-1-yl)-7-ethyl-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one

Catalog ID
STK593115
SMILES CCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1

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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 C20H25N5O2 MW 367.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O2/c1-3-25-16-17(23(2)20(27)22-18(16)26)21-19(25)24-11-9-15(10-12-24)13-14-7-5-4-6-8-14/h4-8,15H,3,9-13H2,1-2H3,(H,22,26,27)
InChIKey
DGZRLPIYVVYWGT-UHFFFAOYSA-N
Synonyms
862487-09-0
8(4BENZYLPIPERIDIN1YL)7ETHYL3METHYLPURINE26DIONE
8(4benzylpiperidin1yl)7ethyl6hydroxy3methyl37dihydro2Hpurin2one
862487090
CCN1C2=C(N=C1N3CCC(CC3)CC4=CC=CC=C4)N(C(=O)NC2=O)C
InChI=1SC20H25N5O2c13251617(23(2)20(27)2218(16)26)2119(25)2411915(101224)13147546814h4815H3913H212H3(H222627)
MFCD07204708
ZINC000004038381
ZINC04038381
ZINC4038381

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.