Vitas-M small molecule compound

1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-bromo-2-chlorophenoxy)ethanone

Catalog ID
STK144977
SMILES Brc1ccc(c(c1)Cl)OCC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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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 C20H20BrClN2O4 MW 467.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrClN2O4/c21-15-2-4-17(16(22)10-15)26-12-20(25)24-7-5-23(6-8-24)11-14-1-3-18-19(9-14)28-13-27-18/h1-4,9-10H,5-8,11-13H2
InChIKey
YXLWVYUVZCMBTI-UHFFFAOYSA-N
Synonyms
462082-55-9
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2(4BROMO2CHLOROPHENOXY)ETHANONE
1(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)2(4bromo2chlorophenoxy)ethanone
462082559
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)COC4=C(C=C(C=C4)Br)Cl
InChI=1SC20H20BrClN2O4c21152417(16(22)1015)261220(25)247523(6824)1114131819(914)28132718h14910H581113H2
MFCD03254991
ZINC000019841179
ZINC19841179

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Available files

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