Vitas-M small molecule compound

8-bromo-1,3-dimethyl-7-[2-(4-methylpiperidin-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK548151
SMILES CC1CCN(CC1)CCn1c(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 C15H22BrN5O2 MW 384.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22BrN5O2/c1-10-4-6-20(7-5-10)8-9-21-11-12(17-14(21)16)18(2)15(23)19(3)13(11)22/h10H,4-9H2,1-3H3
InChIKey
ATNFBABVOAFCIW-UHFFFAOYSA-N
Synonyms
797020-79-2
797020792
8bromo13dimethyl7(2(4methylpiperidin1yl)ethyl)1Hpurine26(3H7H)dione
8bromo13dimethyl7(2(4methylpiperidin1yl)ethyl)37dihydro1Hpurine26dione
8BROMO13DIMETHYL7(2(4METHYLPIPERIDIN1YL)ETHYL)PURINE26DIONE
CC1CCN(CC1)CCN2C3=C(N=C2Br)N(C(=O)N(C3=O)C)C
InChI=1SC15H22BrN5O2c1104620(7510)89211112(1714(21)16)18(2)15(23)19(3)13(11)22h10H49H213H3
MFCD03663751
ZINC000005701529
ZINC5701529

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Available files

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