Vitas-M small molecule compound

(5-nitrobenzene-1,3-diyl)bis{[4-(2-methoxyphenyl)piperazin-1-yl]methanone}

Catalog ID
STK058621
SMILES COc1ccccc1N1CCN(CC1)C(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N1CCN(CC1)c1ccccc1OC

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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 C30H33N5O6 MW 559.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N5O6/c1-40-27-9-5-3-7-25(27)31-11-15-33(16-12-31)29(36)22-19-23(21-24(20-22)35(38)39)30(37)34-17-13-32(14-18-34)26-8-4-6-10-28(26)41-2/h3-10,19-21H,11-18H2,1-2H3
InChIKey
NVJTURWMVKAVFR-UHFFFAOYSA-N
Synonyms
349408-43-1
(3(4(2METHOXYPHENYL)PIPERAZINE1CARBONYL)5NITROPHENYL)(4(2METHOXYPHENYL)PIPERAZIN1YL)METHANONE
(5NITROBENZENE13DIYL)BIS((4(2METHOXYPHENYL)PIPERAZIN1YL)METHANONE)
349408431
4(2METHOXYPHENYL)PIPERAZINYL3((4(2METHOXYPHENYL)PIPERAZINYL)CARBONYL)5NITROPHENYLKETONE
COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC(=C3)(N+)(=O)(O))C(=O)N4CCN(CC4)C5=CC=CC=C5OC
COc1ccccc1N1CCN(CC1)C(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)N1CCN(CC1)c1ccccc1OC
InChI=1SC30H33N5O6c14027953725(27)31111533(161231)29(36)221923(2124(2022)35(38)39)30(37)34171332(141834)268461028(26)412h3101921H1118H212H3
MFCD02974008
STK058621
ZINC000038141741
ZINC38141741

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Available files

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