Vitas-M small molecule compound

(2-fluoro-5-nitrophenyl)[4-(2-fluoro-4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK760177
SMILES Fc1cc(ccc1N1CCN(CC1)C(=O)c1cc(ccc1F)[N+](=O)[O-])[N+](=O)[O-]

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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 C17H14F2N4O5 MW 392.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14F2N4O5/c18-14-3-1-11(22(25)26)9-13(14)17(24)21-7-5-20(6-8-21)16-4-2-12(23(27)28)10-15(16)19/h1-4,9-10H,5-8H2
InChIKey
SIJLUJCQLNVFPO-UHFFFAOYSA-N
Synonyms

(2fluoro5nitrophenyl)(4(2fluoro4nitrophenyl)piperazin1yl)methanone
C1CN(CCN1C2=C(C=C(C=C2)(N+)(=O)(O))F)C(=O)C3=C(C=CC(=C3)(N+)(=O)(O))F
Fc1cc(ccc1N1CCN(CC1)C(=O)c1cc(ccc1F)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC17H14F2N4O5c18143111(22(25)26)913(14)17(24)217520(6821)164212(23(27)28)1015(16)19h14910H58H2
MFCD01572070
ZINC000004182176
ZINC04182176
ZINC4182176

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Available files

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