Vitas-M small molecule compound

7-(3,4-dichlorobenzyl)-8-[(4-methoxybenzyl)oxy]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK697684
SMILES COc1ccc(cc1)COc1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)n(c(=O)n2C)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 C22H20Cl2N4O4 MW 475.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20Cl2N4O4/c1-26-19-18(20(29)27(2)22(26)30)28(11-14-6-9-16(23)17(24)10-14)21(25-19)32-12-13-4-7-15(31-3)8-5-13/h4-10H,11-12H2,1-3H3
InChIKey
QXSQAOMZAWYXLS-UHFFFAOYSA-N
Synonyms
833437-54-0
7((34DICHLOROPHENYL)METHYL)8((4METHOXYPHENYL)METHOXY)13DIMETHYLPURINE26DIONE
7(34dichlorobenzyl)8((4methoxybenzyl)oxy)13dimethyl1Hpurine26(3H7H)dione
7(34dichlorobenzyl)8((4methoxybenzyl)oxy)13dimethyl37dihydro1Hpurine26dione
833437540
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OCC3=CC=C(C=C3)OC)CC4=CC(=C(C=C4)Cl)Cl
InChI=1SC22H20Cl2N4O4c1261918(20(29)27(2)22(26)30)28(11146916(23)17(24)1014)21(2519)3212134715(313)8513h410H1112H213H3
MFCD04197534
ZINC000009210488
ZINC09210488
ZINC9210488

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Available files

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