Vitas-M small molecule compound

2,2'-ethane-1,2-diylbis{3-[(1,3-benzodioxol-5-ylmethyl)amino]-2,3-dihydro-1H-isoindol-1-one}

Catalog ID
STL442605
SMILES O=C1c2ccccc2C(N1CCN1C(NCc2ccc3c(c2)OCO3)c2c(C1=O)cccc2)NCc1ccc2c(c1)OCO2

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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 C34H30N4O6 MW 590.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H30N4O6/c39-33-25-7-3-1-5-23(25)31(35-17-21-9-11-27-29(15-21)43-19-41-27)37(33)13-14-38-32(24-6-2-4-8-26(24)34(38)40)36-18-22-10-12-28-30(16-22)44-20-42-28/h1-12,15-16,31-32,35-36H,13-14,17-20H2
InChIKey
HEBUOFLJIQPCSR-UHFFFAOYSA-N
Synonyms

22ethane12diylbis(3((13benzodioxol5ylmethyl)amino)23dihydro1Hisoindol1one)
MFCD30712245
ZINC000334162918
ZINC000334162920

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Available files

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