Vitas-M small molecule compound

8-bromo-1,3-dimethyl-7-[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK763491
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CC(=O)C13CC4CC(C3)CC(C1)C4)c(n2)Br

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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 C19H23BrN4O3 MW 435.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23BrN4O3/c1-22-15-14(16(26)23(2)18(22)27)24(17(20)21-15)9-13(25)19-6-10-3-11(7-19)5-12(4-10)8-19/h10-12H,3-9H2,1-2H3
InChIKey
RCTGQNOBUGGHNN-UHFFFAOYSA-N
Synonyms
247062-04-0
247062040
7(2((3r5r7r)adamantan1yl)2oxoethyl)8bromo13dimethyl1Hpurine26(3H7H)dione
7(2(1ADAMANTYL)2OXOETHYL)8BROMO13DIMETHYLPURINE26DIONE
8bromo13dimethyl7(2oxo2(tricyclo(3311~37~)dec1yl)ethyl)37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(=O)C34CC5CC(C3)CC(C5)C4
InChI=1SC19H23BrN4O3c1221514(16(26)23(2)18(22)27)24(17(20)2115)913(25)19610311(719)512(410)819h1012H39H212H3
ZINC000004102550
ZINC04102550
ZINC4102550

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Available files

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