Vitas-M small molecule compound

8-bromo-7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK556730
SMILES COc1cc(ccc1OC)C(=O)Cn1c(Br)nc2c1c(=O)n(C)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 C17H17BrN4O5 MW 437.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN4O5/c1-20-14-13(15(24)21(2)17(20)25)22(16(18)19-14)8-10(23)9-5-6-11(26-3)12(7-9)27-4/h5-7H,8H2,1-4H3
InChIKey
BFEWQUYRXOPUSK-UHFFFAOYSA-N
Synonyms
573934-99-3
573934993
8bromo7(2(34dimethoxyphenyl)2oxoethyl)13dimethyl1Hpurine26(3H7H)dione
8bromo7(2(34dimethoxyphenyl)2oxoethyl)13dimethyl37dihydro1Hpurine26dione
8BROMO7(2(34DIMETHOXYPHENYL)2OXOETHYL)13DIMETHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC17H17BrN4O5c1201413(15(24)21(2)17(20)25)22(16(18)1914)810(23)95611(263)12(79)274h57H8H214H3
MFCD04019979
ZINC000037866244
ZINC37866244

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Available files

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