Vitas-M small molecule compound

[2-(3-bromophenyl)-6-methylquinolin-4-yl](4-methylpiperazin-1-yl)methanone

Catalog ID
STK462358
SMILES CN1CCN(CC1)C(=O)c1cc(nc2c1cc(C)cc2)c1cccc(c1)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 C22H22BrN3O MW 424.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrN3O/c1-15-6-7-20-18(12-15)19(22(27)26-10-8-25(2)9-11-26)14-21(24-20)16-4-3-5-17(23)13-16/h3-7,12-14H,8-11H2,1-2H3
InChIKey
AGBVVQLGWCECMZ-UHFFFAOYSA-N
Synonyms

(2(3bromophenyl)6methylquinolin4yl)(4methylpiperazin1yl)methanone
2(3BROMOPHENYL)6METHYL(4QUINOLYL)4METHYLPIPERAZINYLKETONE
CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C)C4=CC(=CC=C4)Br
InChI=1SC22H22BrN3Oc115672018(1215)19(22(27)2610825(2)91126)1421(2420)1643517(23)1316h371214H811H212H3
MFCD05999318
ZINC000020407698
ZINC20407698

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Available files

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