Vitas-M small molecule compound
3-(2-bromophenoxy)-2-methyl-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK569178
SMILES CN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(C)c(c2=O)Oc1ccccc1Br
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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 C22H23BrN2O4 MW 459.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O4/c1-14-21(29-19-6-4-3-5-17(19)23)20(27)15-7-8-18(26)16(22(15)28-14)13-25-11-9-24(2)10-12-25/h3-8,26H,9-13H2,1-2H3InChIKey
DLGYDYZESYNAJC-UHFFFAOYSA-NSynonyms
848916-35-83(2bromophenoxy)2methyl8((4methylpiperazin1ium1yl)methyl)4oxo4Hchromen7olate
3(2BROMOPHENOXY)2METHYL8((4METHYLPIPERAZIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
3(2BROMOPHENOXY)7HYDROXY2METHYL8((4METHYLPIPERAZIN1YL)METHYL)CHROMEN4ONE
3(2BROMOPHENOXY)7HYDROXY2METHYL8((4METHYLPIPERAZINYL)METHYL)CHROMEN4ONE
CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCN(CC3)C)OC4=CC=CC=C4Br
CN1CC(NH+)(CC1)Cc1c((O))ccc2c1oc(C)c(c2=O)Oc1ccccc1Br
InChI=1SC22H23BrN2O4c11421(2919643517(19)23)20(27)157818(26)16(22(15)2814)132511924(2)101225h3826H913H212H3
MFCD04197959
ZINC000020412355
ZINC20412355
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