Vitas-M small molecule compound

8-[2-(2,4-dichlorophenoxy)ethoxy]-1-(4-fluorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK697786
SMILES Fc1ccc(cc1)Cn1c(=O)c2n(C)c(nc2n(c1=O)C)OCCOc1ccc(cc1Cl)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 C22H19Cl2FN4O4 MW 493.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl2FN4O4/c1-27-18-19(26-21(27)33-10-9-32-17-8-5-14(23)11-16(17)24)28(2)22(31)29(20(18)30)12-13-3-6-15(25)7-4-13/h3-8,11H,9-10,12H2,1-2H3
InChIKey
AIOPZHHFHVPYQI-UHFFFAOYSA-N
Synonyms
953909-37-0
8(2(24dichlorophenoxy)ethoxy)1((4fluorophenyl)methyl)37dimethylpurine26dione
8(2(24dichlorophenoxy)ethoxy)1(4fluorobenzyl)37dimethyl1Hpurine26(3H7H)dione
8(2(24dichlorophenoxy)ethoxy)1(4fluorobenzyl)37dimethyl37dihydro1Hpurine26dione
953909370
CN1C2=C(N=C1OCCOC3=C(C=C(C=C3)Cl)Cl)N(C(=O)N(C2=O)CC4=CC=C(C=C4)F)C
InChI=1SC22H19Cl2FN4O4c1271819(2621(27)3310932178514(23)1116(17)24)28(2)22(31)29(20(18)30)12133615(25)7413h3811H91012H212H3
MFCD04157721
ZINC000009192416
ZINC09192416
ZINC9192416

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Available files

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