Vitas-M small molecule compound
7-butyl-8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK769698
SMILES CCCCn1c(Oc2ccc(cc2)Oc2ncc(cc2Cl)Cl)nc2c1c(=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 C22H21Cl2N5O4 MW 490.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2N5O4/c1-4-5-10-29-17-18(27(2)22(31)28(3)20(17)30)26-21(29)33-15-8-6-14(7-9-15)32-19-16(24)11-13(23)12-25-19/h6-9,11-12H,4-5,10H2,1-3H3InChIKey
VOYIGVVRWONAOM-UHFFFAOYSA-NSynonyms
7butyl8(4((35dichloropyridin2yl)oxy)phenoxy)13dimethyl37dihydro1Hpurine26dione
7BUTYL8(4(35DICHLOROPYRIDIN2YL)OXYPHENOXY)13DIMETHYLPURINE26DIONE
CCCCN1C2=C(N=C1OC3=CC=C(C=C3)OC4=C(C=C(C=N4)Cl)Cl)N(C(=O)N(C2=O)C)C
InChI=1SC22H21Cl2N5O4c14510291718(27(2)22(31)28(3)20(17)30)2621(29)33158614(7915)321916(24)1113(23)122519h691112H4510H213H3
MFCD03763495
ZINC000008846477
ZINC08846477
ZINC8846477
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