Vitas-M small molecule compound

(2,2-dibromo-1-methylcyclopropyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK469111
SMILES O=C(C1(C)CC1(Br)Br)N1CCN(CC1)c1ccc(cc1)[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 C15H17Br2N3O3 MW 447.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17Br2N3O3/c1-14(10-15(14,16)17)13(21)19-8-6-18(7-9-19)11-2-4-12(5-3-11)20(22)23/h2-5H,6-10H2,1H3
InChIKey
AXZVLSUWLUWFQV-UHFFFAOYSA-N
Synonyms

(22dibromo1methylcyclopropyl)(4(4nitrophenyl)piperazin1yl)methanone
22DIBROMO1METHYLCYCLOPROPYL4(4NITROPHENYL)PIPERAZINYLKETONE
CC1(CC1(Br)Br)C(=O)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC15H17Br2N3O3c114(1015(1416)17)13(21)198618(7919)112412(5311)20(22)23h25H610H21H3
MFCD01070067
O=C(C1(C)CC1(Br)Br)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000012384399
ZINC000012384400

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Available files

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