Vitas-M small molecule compound

6,8-bis[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-2-phenyl-4H-chromene-5,7-diolate

Catalog ID
STL514088
SMILES CN1CC[NH+](CC1)Cc1c([O-])c(C[NH+]2CCN(CC2)C)c(c2c1oc(cc2=O)c1ccccc1)[O-]

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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 C27H34N4O4 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O4/c1-28-8-12-30(13-9-28)17-20-25(33)21(18-31-14-10-29(2)11-15-31)27-24(26(20)34)22(32)16-23(35-27)19-6-4-3-5-7-19/h3-7,16,33-34H,8-15,17-18H2,1-2H3
InChIKey
UBKFCDNRXWOUHI-UHFFFAOYSA-N
Synonyms
384362-08-7
384362087
4600304
68bis((4methylpiperazin1ium1yl)methyl)4oxo2phenyl4Hchromene57diolate
MFCD03146418
ZINC000020113087

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Available files

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