Vitas-M small molecule compound

(2-bromophenyl)[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK148678
SMILES Brc1ccccc1C(=O)N1CCN(CC1)c1c(Cl)cccc1[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 C17H15BrClN3O3 MW 424.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrClN3O3/c18-13-5-2-1-4-12(13)17(23)21-10-8-20(9-11-21)16-14(19)6-3-7-15(16)22(24)25/h1-7H,8-11H2
InChIKey
YSUUKAAHSFUDIO-UHFFFAOYSA-N
Synonyms

(2BROMOPHENYL)(4(2CHLORO6NITROPHENYL)PIPERAZIN1YL)METHANONE
2BROMOPHENYL4(6CHLORO2NITROPHENYL)PIPERAZINYLKETONE
Brc1ccccc1C(=O)N1CCN(CC1)c1c(Cl)cccc1(N+)(=O)(O)
C1CN(CCN1C2=C(C=CC=C2Cl)(N+)(=O)(O))C(=O)C3=CC=CC=C3Br
InChI=1SC17H15BrClN3O3c1813521412(13)17(23)2110820(91121)1614(19)63715(16)22(24)25h17H811H2
MFCD02182416
ZINC000008816317
ZINC08816317
ZINC8816317

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Available files

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