Vitas-M small molecule compound

7-(4-bromobenzyl)-1,3-dimethyl-8-[(2-methylpropyl)amino]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK804391
SMILES CC(CNc1nc2c(n1Cc1ccc(cc1)Br)c(=O)n(c(=O)n2C)C)C

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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 C18H22BrN5O2 MW 420.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22BrN5O2/c1-11(2)9-20-17-21-15-14(16(25)23(4)18(26)22(15)3)24(17)10-12-5-7-13(19)8-6-12/h5-8,11H,9-10H2,1-4H3,(H,20,21)
InChIKey
CWJLIVGOXHLEHJ-UHFFFAOYSA-N
Synonyms
309937-81-3
309937813
7((4BROMOPHENYL)METHYL)13DIMETHYL8(2METHYLPROPYLAMINO)PURINE26DIONE
7(4bromobenzyl)13dimethyl8((2methylpropyl)amino)37dihydro1Hpurine26dione
7(4bromobenzyl)8(isobutylamino)13dimethyl1Hpurine26(3H7H)dione
CC(C)CNC1=NC2=C(N1CC3=CC=C(C=C3)Br)C(=O)N(C(=O)N2C)C
InChI=1SC18H22BrN5O2c111(2)92017211514(16(25)23(4)18(26)22(15)3)24(17)10125713(19)8612h5811H910H214H3(H2021)
MFCD01564576
ZINC000004785936
ZINC04785936
ZINC4785936

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Available files

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