Vitas-M small molecule compound
1-(3-chlorobenzyl)-8-[(2-chlorobenzyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK013703
SMILES Clc1cccc(c1)Cn1c(=O)c2n(C)c(nc2n(c1=O)C)NCc1ccccc1Cl
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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 C21H19Cl2N5O2 MW 444.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N5O2/c1-26-17-18(25-20(26)24-11-14-7-3-4-9-16(14)23)27(2)21(30)28(19(17)29)12-13-6-5-8-15(22)10-13/h3-10H,11-12H2,1-2H3,(H,24,25)InChIKey
AGYGFILXFRHPNE-UHFFFAOYSA-NSynonyms
1((3CHLOROPHENYL)METHYL)8((2CHLOROPHENYL)METHYLAMINO)37DIMETHYLPURINE26DIONE
1(3CHLOROBENZYL)8((2CHLOROBENZYL)AMINO)37DIMETHYL37DIHYDRO1HPURINE26DIONE
Clc1cccc(c1)Cn1c(=O)c2n(C)c(nc2n(c1=O)C)NCc1ccccc1Cl
CN1C2=C(N=C1NCC3=CC=CC=C3Cl)N(C(=O)N(C2=O)CC4=CC(=CC=C4)Cl)C
InChI=1SC21H19Cl2N5O2c1261718(2520(26)241114734916(14)23)27(2)21(30)28(19(17)29)121365815(22)1013h310H1112H212H3(H2425)
MFCD02070715
STK013703
ZINC000001110051
ZINC01110051
ZINC1110051
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