Vitas-M small molecule compound
ethyl 6-bromo-4-hydroxy-5-methoxy-2-methyl-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-carboxylate
Catalog ID
STK524818
SMILES CCOC(=O)c1c(C)oc2c1c(O)c(OC)c(c2CN1CCN(CC1)C)Br
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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 C19H25BrN2O5 MW 441.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25BrN2O5/c1-5-26-19(24)13-11(2)27-17-12(10-22-8-6-21(3)7-9-22)15(20)18(25-4)16(23)14(13)17/h23H,5-10H2,1-4H3InChIKey
IEQNKBXTFJWDGB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC2=C1C(=C(C(=C2CN3CCN(CC3)C)Br)OC)O)C
CCOC(=O)c1c(C)oc2c1c(O)c(OC)c(c2CN1CCN(CC1)C)BrClCl
ethyl6bromo4hydroxy5methoxy2methyl7((4methylpiperazin1yl)methyl)1benzofuran3carboxylate
ethyl6bromo4hydroxy5methoxy2methyl7((4methylpiperazin1yl)methyl)benzofuran3carboxylatedihydrochloride
InChI=1SC19H25BrN2O5c152619(24)1311(2)271712(10228621(3)7922)15(20)18(254)16(23)14(13)17h23H510H214H3
MFCD01560215
ZINC000020827107
ZINC20827107
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