Vitas-M small molecule compound

2-(4-chloro-3,5-dimethylphenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone

Catalog ID
STK817147
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)COc1cc(C)c(c(c1)C)Cl

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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 C21H25ClN2O3 MW 388.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN2O3/c1-15-12-19(13-16(2)21(15)22)27-14-20(25)24-10-8-23(9-11-24)17-4-6-18(26-3)7-5-17/h4-7,12-13H,8-11,14H2,1-3H3
InChIKey
XBMKXFCEAANHQU-UHFFFAOYSA-N
Synonyms

2(4chloro35dimethylphenoxy)1(4(4methoxyphenyl)piperazin1yl)ethanone
CC1=CC(=CC(=C1Cl)C)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC
InChI=1SC21H25ClN2O3c1151219(1316(2)21(15)22)271420(25)2410823(91124)174618(263)7517h471213H81114H213H3
MFCD03507649
ZINC000002830687
ZINC02830687
ZINC2830687

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Available files

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