Vitas-M small molecule compound

[6-bromo-2-(4-butylphenyl)quinolin-4-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK429000
SMILES CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])Br

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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 C30H29BrN4O3 MW 573.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29BrN4O3/c1-2-3-4-21-5-7-22(8-6-21)29-20-27(26-19-23(31)9-14-28(26)32-29)30(36)34-17-15-33(16-18-34)24-10-12-25(13-11-24)35(37)38/h5-14,19-20H,2-4,15-18H2,1H3
InChIKey
SJXIQVIXKCRCFJ-UHFFFAOYSA-N
Synonyms
(6bromo2(4butylphenyl)quinolin4yl)(4(4nitrophenyl)piperazin1yl)methanone
6BROMO2(4BUTYLPHENYL)(4QUINOLYL)4(4NITROPHENYL)PIPERAZINYLKETONE
6BROMO2(4BUTYLPHENYL)4((4(4NITROPHENYL)1PIPERAZINYL)CARBONYL)QUINOLINE
6BROMO2(4BUTYLPHENYL)4((4(4NITROPHENYL)PIPERAZIN1YL)CARBONYL)QUINOLINE
CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)C5=CC=C(C=C5)(N+)(=O)(O)
CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O))Br
Registry IDs
MFCD03234086
ZINC000008450866
ZINC08450866
ZINC8450866

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Available files

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