Vitas-M small molecule compound

7-benzyl-1,3-dimethyl-8-(propylamino)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK262493
SMILES CCCNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

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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 C17H21N5O2 MW 327.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O2/c1-4-10-18-16-19-14-13(15(23)21(3)17(24)20(14)2)22(16)11-12-8-6-5-7-9-12/h5-9H,4,10-11H2,1-3H3,(H,18,19)
InChIKey
NAHBCXLCAHCJKH-UHFFFAOYSA-N
Synonyms
377049-95-1
13DIMETHYL7BENZYL8(PROPYLAMINO)137TRIHYDROPURINE26DIONE
7BENZYL13DIMETHYL8(PROPYLAMINO)1HPURINE26(3H7H)DIONE
7benzyl13dimethyl8(propylamino)37dihydro1Hpurine26dione
7BENZYL13DIMETHYL8(PROPYLAMINO)PURINE26DIONE
7BENZYL13DIMETHYL8PROPYLAMINO37DIHYDROPURINE26DIONE
CCCNC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)C
Registry IDs
MFCD02735957
ZINC000012647624
ZINC12647624

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Available files

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