Vitas-M small molecule compound

[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl](4-methoxyphenyl)methanone

Catalog ID
STK011496
SMILES COc1ccc(cc1)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 C28H32N4O6 MW 520.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O6/c1-36-23-8-5-21(6-9-23)28(33)31-16-14-30(15-17-31)22-7-10-25(32(34)35)24(19-22)29-13-12-20-4-11-26(37-2)27(18-20)38-3/h4-11,18-19,29H,12-17H2,1-3H3
InChIKey
WTDAXWUPWALGAO-UHFFFAOYSA-N
Synonyms

(4(3((2(34DIMETHOXYPHENYL)ETHYL)AMINO)4NITROPHENYL)PIPERAZIN1YL)(4METHOXYPHENYL)METHANONE
(4(3((34dimethoxyphenethyl)amino)4nitrophenyl)piperazin1yl)(4methoxyphenyl)methanone
(4(3(2(34DIMETHOXYPHENYL)ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(4METHOXYPHENYL)METHANONE
4(3((2(34DIMETHOXYPHENYL)ETHYL)AMINO)4NITROPHENYL)PIPERAZINYL4METHOXYPHENYLKETONE
COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCCC4=CC(=C(C=C4)OC)OC
COc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCCc1ccc(c(c1)OC)OC)(N+)(=O)(O)
InChI=1SC28H32N4O6c136238521(6923)28(33)31161430(151731)2271025(32(34)35)24(1922)2913122041126(372)27(1820)383h411181929H1217H213H3
MFCD02625920
N(2(34DIMETHOXYPHENYL)ETHYL)5(4((4METHOXYPHENYL)CARBONYL)PIPERAZIN1YL)2NITROANILINE
STK011496
ZINC000008691119
ZINC08691119
ZINC8691119

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Available files

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