Vitas-M small molecule compound

8-(azepanium-1-ylmethyl)-3-(1-methyl-1H-benzimidazol-2-yl)-2-oxo-2H-chromen-7-olate

Catalog ID
STL514282
SMILES [O-]c1ccc2c(c1C[NH+]1CCCCCC1)oc(=O)c(c2)c1nc2c(n1C)cccc2

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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 C24H25N3O3 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3/c1-26-20-9-5-4-8-19(20)25-23(26)17-14-16-10-11-21(28)18(22(16)30-24(17)29)15-27-12-6-2-3-7-13-27/h4-5,8-11,14,28H,2-3,6-7,12-13,15H2,1H3
InChIKey
IFELNQIONKPPGK-UHFFFAOYSA-N
Synonyms
384364-16-3
384364163
4267336
8(azepanium1ylmethyl)3(1methyl1Hbenzimidazol2yl)2oxo2Hchromen7olate
MFCD03146328
ZINC000001155575

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Available files

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