Vitas-M small molecule compound
3-(2-bromophenoxy)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK587055
SMILES CN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(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 C21H21BrN2O4 MW 445.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O4/c1-23-8-10-24(11-9-23)12-15-17(25)7-6-14-20(26)19(13-27-21(14)15)28-18-5-3-2-4-16(18)22/h2-7,13,25H,8-12H2,1H3InChIKey
LKCQMPARHYYBQV-UHFFFAOYSA-NSynonyms
846064-65-13(2BROMOPHENOXY)7HYDROXY8((4METHYLPIPERAZIN1YL)METHYL)CHROMEN4ONE
3(2BROMOPHENOXY)7HYDROXY8((4METHYLPIPERAZINYL)METHYL)CHROMEN4ONE
3(2bromophenoxy)8((4methylpiperazin1ium1yl)methyl)4oxo4Hchromen7olate
3(2bromophenoxy)8((4methylpiperazin1ium1yl)methyl)4oxochromen7olate
846064651
CN1CC(NH+)(CC1)Cc1c((O))ccc2c1occ(c2=O)Oc1ccccc1Br
CN1CC(NH+)(CC1)CC2=C(C=CC3=C2OC=C(C3=O)OC4=CC=CC=C4Br)(O)
InChI=1SC21H21BrN2O4c12381024(11923)121517(25)761420(26)19(132721(14)15)2818532416(18)22h271325H812H21H3
MFCD04173929
ZINC000020392562
ZINC20392562
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