Vitas-M small molecule compound

2,6-dimethoxy-4-({4-[(2-methoxyphenyl)carbonyl]piperazin-1-ium-1-yl}methyl)phenolate

Catalog ID
STK561673
SMILES COc1ccccc1C(=O)N1CC[NH+](CC1)Cc1cc(OC)c(c(c1)OC)[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 C21H26N2O5 MW 386.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O5/c1-26-17-7-5-4-6-16(17)21(25)23-10-8-22(9-11-23)14-15-12-18(27-2)20(24)19(13-15)28-3/h4-7,12-13,24H,8-11,14H2,1-3H3
InChIKey
PYCDTRGHYATXSG-UHFFFAOYSA-N
Synonyms

COc1ccccc1C(=O)N1CC(NH+)(CC1)Cc1cc(OC)c(c(c1)OC)(O)
MFCD02107994
ZINC000019568758

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Available files

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