Vitas-M small molecule compound

8-(azepan-1-yl)-1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK839085
SMILES CC(=C)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCCCCC1

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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 C17H25N5O2 MW 331.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N5O2/c1-12(2)11-22-13-14(19(3)17(24)20(4)15(13)23)18-16(22)21-9-7-5-6-8-10-21/h1,5-11H2,2-4H3
InChIKey
LFAGYQJEMIXILS-UHFFFAOYSA-N
Synonyms
377064-00-1
377064001
8(azepan1yl)13dimethyl7(2methylallyl)1Hpurine26(3H7H)dione
8(azepan1yl)13dimethyl7(2methylprop2en1yl)37dihydro1Hpurine26dione
8(AZEPAN1YL)13DIMETHYL7(2METHYLPROP2ENYL)PURINE26DIONE
8AZAPERHYDROEPINYL13DIMETHYL7(2METHYLPROP2ENYL)137TRIHYDROPURINE26DIONE
8AZEPAN1YL13DIMETHYL7(2METHYLALLYL)37DIHYDROPURINE26DIONE
CC(=C)CN1C2=C(N=C1N3CCCCCC3)N(C(=O)N(C2=O)C)C
InChI=1SC17H25N5O2c112(2)11221314(19(3)17(24)20(4)15(13)23)1816(22)21975681021h1511H224H3
MFCD02227470
ZINC000000287552
ZINC00287552
ZINC287552

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Available files

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