Vitas-M small molecule compound
7-(3-bromobenzyl)-3-methyl-8-(propylamino)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL494600
SMILES CCCNc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]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 C16H18BrN5O2 MW 392.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrN5O2/c1-3-7-18-15-19-13-12(14(23)20-16(24)21(13)2)22(15)9-10-5-4-6-11(17)8-10/h4-6,8H,3,7,9H2,1-2H3,(H,18,19)(H,20,23,24)InChIKey
CKOMTIXKMWULCV-UHFFFAOYSA-NSynonyms
476480-63-4476480634
7((3BROMOPHENYL)METHYL)3METHYL8(PROPYLAMINO)PURINE26DIONE
7(3BROMOBENZYL)3METHYL8(PROPYLAMINO)1HPURINE26(3H7H)DIONE
7(3bromobenzyl)3methyl8(propylamino)37dihydro1Hpurine26dione
7(3BROMOBENZYL)6HYDROXY3METHYL8(PROPYLAMINO)37DIHYDRO2HPURIN2ONE
CCCNC1=NC2=C(N1CC3=CC(=CC=C3)Br)C(=O)NC(=O)N2C
CCCNc1nc2c(n1Cc1cccc(c1)Br)c(=O)(nH)c(=O)n2C
InChI=1SC16H18BrN5O2c1371815191312(14(23)2016(24)21(13)2)22(15)91054611(17)810h468H379H212H3(H1819)(H202324)
MFCD03933608
ZINC000001839078
ZINC01839078
ZINC1839078
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