Vitas-M small molecule compound

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

Catalog ID
STK599684
SMILES CCCn1c(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 C21H27N5O2 MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2/c1-3-11-26-17-18(24(2)21(28)23-19(17)27)22-20(26)25-12-9-16(10-13-25)14-15-7-5-4-6-8-15/h4-8,16H,3,9-14H2,1-2H3,(H,23,27,28)
InChIKey
MJAKPWFYNVBIMK-UHFFFAOYSA-N
Synonyms
850749-83-6
8(4BENZYLPIPERIDIN1YL)3METHYL7PROPYLPURINE26DIONE
8(4benzylpiperidin1yl)6hydroxy3methyl7propyl37dihydro2Hpurin2one
850749836
CCCN1C2=C(N=C1N3CCC(CC3)CC4=CC=CC=C4)N(C(=O)NC2=O)C
InChI=1SC21H27N5O2c1311261718(24(2)21(28)2319(17)27)2220(26)2512916(101325)14157546815h4816H3914H212H3(H232728)
MFCD07209609
ZINC000002419622
ZINC02419622
ZINC2419622

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Available files

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