Vitas-M small molecule compound

7-heptyl-3-methyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK527111
SMILES CCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1

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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 C17H27N5O3 MW 349.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H27N5O3/c1-3-4-5-6-7-8-22-13-14(20(2)17(24)19-15(13)23)18-16(22)21-9-11-25-12-10-21/h3-12H2,1-2H3,(H,19,23,24)
InChIKey
UCCDEZCMCIYQAM-UHFFFAOYSA-N
Synonyms
302788-86-9
302788869
7heptyl3methyl8(morpholin4yl)37dihydro1Hpurine26dione
7heptyl3methyl8morpholino1Hpurine26(3H7H)dione
CCCCCCCn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCOCC1
CCCCCCCN1C2=C(N=C1N3CCOCC3)N(C(=O)NC2=O)C
InChI=1SC17H27N5O3c1345678221314(20(2)17(24)1915(13)23)1816(22)2191125121021h312H212H3(H192324)
MFCD00687838
ZINC000002286036

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Available files

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