Vitas-M small molecule compound

3-(4-bromophenyl)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate

Catalog ID
STL045330
SMILES CN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)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 C21H21BrN2O3 MW 429.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O3/c1-23-8-10-24(11-9-23)12-17-19(25)7-6-16-20(26)18(13-27-21(16)17)14-2-4-15(22)5-3-14/h2-7,13,25H,8-12H2,1H3
InChIKey
WPKMXENBXGWCTD-UHFFFAOYSA-N
Synonyms
637747-20-7
3(4bromophenyl)8((4methylpiperazin1ium1yl)methyl)4oxo4Hchromen7olate
CN1CC(NH+)(CC1)Cc1c((O))ccc2c1occ(c2=O)c1ccc(cc1)Br

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.