Vitas-M small molecule compound
methyl 3-[3-hydroxy-5-(4-methoxybenzyl)-1H-pyrazol-4-yl]-3-(quinoxalin-5-yl)propanoate
Catalog ID
STL408479
SMILES COC(=O)CC(c1cccc2c1nccn2)c1c([nH]nc1O)Cc1ccc(cc1)OC
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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 C23H22N4O4 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4/c1-30-15-8-6-14(7-9-15)12-19-21(23(29)27-26-19)17(13-20(28)31-2)16-4-3-5-18-22(16)25-11-10-24-18/h3-11,17H,12-13H2,1-2H3,(H2,26,27,29)InChIKey
HQERUPJQZXKWFE-UHFFFAOYSA-NSynonyms
1574405-26-71574405267
COC(=O)CC(c1cccc2c1nccn2)c1c((nH)nc1O)Cc1ccc(cc1)OC
COC1=CC=C(C=C1)CC2=C(C(=O)NN2)C(CC(=O)OC)C3=C4C(=CC=C3)N=CC=N4
InChI=1SC23H22N4O4c130158614(7915)121921(23(29)272619)17(1320(28)312)164351822(16)2511102418h31117H1213H212H3(H2262729)
methyl3(3((4methoxyphenyl)methyl)5oxo12dihydropyrazol4yl)3quinoxalin5ylpropanoate
methyl3(3hydroxy5(4methoxybenzyl)1Hpyrazol4yl)3(quinoxalin5yl)propanoate
MFCD30705242
ZINC000096117850
ZINC000096117851
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