Vitas-M small molecule compound
(3-bromo-4-methoxyphenyl)[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STK009902
SMILES COc1ccc(cc1Br)C(=O)N1CCN(CC1)c1ccc(c(c1)NCCc1ccc(c(c1)OC)OC)[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 C28H31BrN4O6 MW 599.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31BrN4O6/c1-37-25-9-5-20(17-22(25)29)28(34)32-14-12-31(13-15-32)21-6-7-24(33(35)36)23(18-21)30-11-10-19-4-8-26(38-2)27(16-19)39-3/h4-9,16-18,30H,10-15H2,1-3H3InChIKey
WLFDRZLNBYBMIM-UHFFFAOYSA-NSynonyms
(3BROMO4METHOXYPHENYL)(4(3((2(34DIMETHOXYPHENYL)ETHYL)AMINO)4NITROPHENYL)PIPERAZIN1YL)METHANONE
(3bromo4methoxyphenyl)(4(3((34dimethoxyphenethyl)amino)4nitrophenyl)piperazin1yl)methanone
(3BROMO4METHOXYPHENYL)(4(3(2(34DIMETHOXYPHENYL)ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)METHANONE
COC1=C(C=C(C=C1)CCNC2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)Br)(N+)(=O)(O))OC
COc1ccc(cc1Br)C(=O)N1CCN(CC1)c1ccc(c(c1)NCCc1ccc(c(c1)OC)OC)(N+)(=O)(O)
InChI=1SC28H31BrN4O6c137259520(1722(25)29)28(34)32141231(131532)216724(33(35)36)23(1821)301110194826(382)27(1619)393h49161830H1015H213H3
MFCD02627831
STK009902
ZINC000100233222
ZINC100233222
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.