Vitas-M small molecule compound
4-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-(4-bromophenyl)phthalazin-1(2H)-one
Catalog ID
STL096930
SMILES Brc1ccc(cc1)n1nc(c2onc(n2)c2ccc3c(c2)OCO3)c2c(c1=O)cccc2
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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 C23H13BrN4O4 MW 489.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13BrN4O4/c24-14-6-8-15(9-7-14)28-23(29)17-4-2-1-3-16(17)20(26-28)22-25-21(27-32-22)13-5-10-18-19(11-13)31-12-30-18/h1-11H,12H2InChIKey
PYCLPJGKTPSXJD-UHFFFAOYSA-NSynonyms
4(3(13benzodioxol5yl)124oxadiazol5yl)2(4bromophenyl)phthalazin1(2H)one
4(3(13benzodioxol5yl)124oxadiazol5yl)2(4bromophenyl)phthalazin1one
C1OC2=C(O1)C=C(C=C2)C3=NOC(=N3)C4=NN(C(=O)C5=CC=CC=C54)C6=CC=C(C=C6)Br
InChI=1SC23H13BrN4O4c24146815(9714)2823(29)17421316(17)20(2628)222521(273222)135101819(1113)31123018h111H12H2
MFCD18788815
ZINC000064949928
ZINC64949928
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