Vitas-M small molecule compound
1-benzyl-8-bromo-7-(4-chlorobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK050346
SMILES Clc1ccc(cc1)Cn1c(Br)nc2c1c(=O)n(c(=O)n2C)Cc1ccccc1
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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 C20H16BrClN4O2 MW 459.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClN4O2/c1-24-17-16(18(27)26(20(24)28)12-13-5-3-2-4-6-13)25(19(21)23-17)11-14-7-9-15(22)10-8-14/h2-10H,11-12H2,1H3InChIKey
FFBQTLHNBOQSDH-UHFFFAOYSA-NSynonyms
331840-00-71BENZYL8BROMO7((4CHLOROPHENYL)METHYL)3METHYLPURINE26DIONE
1BENZYL8BROMO7(4CHLOROBENZYL)3METHYL1HPURINE26(3H7H)DIONE
1BENZYL8BROMO7(4CHLOROBENZYL)3METHYL37DIHYDRO1HPURINE26DIONE
1BENZYL8BROMO7(4CHLOROBENZYL)3METHYL37DIHYDROPURINE26DIONE
331840007
Clc1ccc(cc1)Cn1c(Br)nc2c1c(=O)n(c(=O)n2C)Cc1ccccc1
CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N(C(=N2)Br)CC4=CC=C(C=C4)Cl
InChI=1SC20H16BrClN4O2c1241716(18(27)26(20(24)28)12135324613)25(19(21)2317)11147915(22)10814h210H1112H21H3
MFCD01051230
STK050346
ZINC000000633229
ZINC00633229
ZINC633229
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