Vitas-M small molecule compound

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

Catalog ID
STK805868
SMILES Clc1ccccc1Cn1c(Br)nc2c1c(=O)n(Cc1ccccc1Cl)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 C20H15BrCl2N4O2 MW 494.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrCl2N4O2/c1-25-17-16(26(19(21)24-17)10-12-6-2-4-8-14(12)22)18(28)27(20(25)29)11-13-7-3-5-9-15(13)23/h2-9H,10-11H2,1H3
InChIKey
PQHFFRWYJHNDKY-UHFFFAOYSA-N
Synonyms
303973-59-3
303973593
8BROMO17BIS((2CHLOROPHENYL)METHYL)3METHYLPURINE26DIONE
8bromo17bis(2chlorobenzyl)3methyl1Hpurine26(3H7H)dione
8bromo17bis(2chlorobenzyl)3methyl37dihydro1Hpurine26dione
8BROMO17BIS(2CHLOROBENZYL)3METHYL37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3Cl)N(C(=N2)Br)CC4=CC=CC=C4Cl
InChI=1SC20H15BrCl2N4O2c1251716(26(19(21)2417)1012624814(12)22)18(28)27(20(25)29)1113735915(13)23h29H1011H21H3
MFCD01143469
ZINC000000647540
ZINC00647540
ZINC647540

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Available files

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