Vitas-M small molecule compound
8-[benzyl(methyl)amino]-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL341005
SMILES Fc1cccc(c1Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N(Cc1ccccc1)C)Cl
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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 C22H21ClFN5O2 MW 441.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClFN5O2/c1-26(12-14-8-5-4-6-9-14)21-25-19-18(20(30)28(3)22(31)27(19)2)29(21)13-15-16(23)10-7-11-17(15)24/h4-11H,12-13H2,1-3H3InChIKey
XGOHAUWRZRLNBN-UHFFFAOYSA-NSynonyms
578743-96-1578743961
8(BENZYL(METHYL)AMINO)7((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(benzyl(methyl)amino)7(2chloro6fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8(benzyl(methyl)amino)7(2chloro6fluorobenzyl)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(C)CC3=CC=CC=C3)CC4=C(C=CC=C4Cl)F
InChI=1SC22H21ClFN5O2c126(12148546914)21251918(20(30)28(3)22(31)27(19)2)29(21)131516(23)1071117(15)24h411H1213H213H3
MFCD04024000
ZINC000001238420
ZINC01238420
ZINC1238420
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