Vitas-M small molecule compound

8-bromo-3-methyl-7-(2-oxopropyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK867886
SMILES CC(=O)Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

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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 C9H9BrN4O3 MW 301.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9BrN4O3/c1-4(15)3-14-5-6(11-8(14)10)13(2)9(17)12-7(5)16/h3H2,1-2H3,(H,12,16,17)
InChIKey
KWVAIJKGSCETHM-UHFFFAOYSA-N
Synonyms
101072-01-9
101072019
1HPURINE26DIONE8BROMO37DIHYDRO3METHYL7(2OXOPROPYL)
8BROMO3METHYL7(2OXOPROPYL)137TRIHYDROPURINE26DIONE
8BROMO3METHYL7(2OXOPROPYL)1HPURINE26(3H7H)DIONE
8bromo3methyl7(2oxopropyl)37dihydro1Hpurine26dione
8BROMO3METHYL7(2OXOPROPYL)37DIHYDROPURINE26DIONE
8BROMO3METHYL7(2OXOPROPYL)PURINE26DIONE
CC(=O)Cn1c(Br)nc2c1c(=O)(nH)c(=O)n2C
CC(=O)CN1C2=C(N=C1Br)N(C(=O)NC2=O)C
InChI=1SC9H9BrN4O3c14(15)31456(118(14)10)13(2)9(17)127(5)16h3H212H3(H121617)
MFCD01032095
ZINC000000180714
ZINC00180714
ZINC180714

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Available files

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