Vitas-M small molecule compound

[2-(2,4-dimethylphenyl)quinolin-4-yl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone

Catalog ID
STK458505
SMILES Cc1ccc(c(c1)C)c1nc2ccccc2c(c1)C(=O)N1CCN(CC1)c1ncccn1

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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 C26H25N5O MW 423.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O/c1-18-8-9-20(19(2)16-18)24-17-22(21-6-3-4-7-23(21)29-24)25(32)30-12-14-31(15-13-30)26-27-10-5-11-28-26/h3-11,16-17H,12-15H2,1-2H3
InChIKey
ZCUMNMVFGXSXIU-UHFFFAOYSA-N
Synonyms

(2(24dimethylphenyl)quinolin4yl)(4(pyrimidin2yl)piperazin1yl)methanone
(2(24DIMETHYLPHENYL)QUINOLIN4YL)(4PYRIMIDIN2YLPIPERAZIN1YL)METHANONE
2(24DIMETHYLPHENYL)(4QUINOLYL)4PYRIMIDIN2YLPIPERAZINYLKETONE
CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=NC=CC=N5)C
InChI=1SC26H25N5Oc1188920(19(2)1618)241722(21634723(21)2924)25(32)30121431(151330)2627105112826h3111617H1215H212H3
MFCD03397337
ZINC000006271804
ZINC06271804
ZINC6271804

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Available files

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