Vitas-M small molecule compound

(3-methyl-4-nitrophenyl)[4-(pyridin-2-yl)piperazin-1-yl]methanone

Catalog ID
STK710652
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])N1CCN(CC1)c1ccccn1

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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 C17H18N4O3 MW 326.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O3/c1-13-12-14(5-6-15(13)21(23)24)17(22)20-10-8-19(9-11-20)16-4-2-3-7-18-16/h2-7,12H,8-11H2,1H3
InChIKey
OGLDHXJIOZYGII-UHFFFAOYSA-N
Synonyms
431934-76-8
(3methyl4nitrophenyl)(4(pyridin2yl)piperazin1yl)methanone
(3METHYL4NITROPHENYL)(4PYRIDIN2YLPIPERAZIN1YL)METHANONE
431934768
CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=N3)(N+)(=O)(O)
InChI=1SC17H18N4O3c1131214(5615(13)21(23)24)17(22)2010819(91120)1642371816h2712H811H21H3
MFCD03141378
O=C(c1ccc(c(c1)C)(N+)(=O)(O))N1CCN(CC1)c1ccccn1
ZINC000000316968
ZINC316968

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Available files

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