Vitas-M small molecule compound

1-{4-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]phenyl}ethanone

Catalog ID
STK463658
SMILES O=C(c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccc(cc1)C(=O)C

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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 C20H20N2O4 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4/c1-14(23)15-2-5-17(6-3-15)21-8-10-22(11-9-21)20(24)16-4-7-18-19(12-16)26-13-25-18/h2-7,12H,8-11,13H2,1H3
InChIKey
DMJGPASMZSNEAZ-UHFFFAOYSA-N
Synonyms
774589-47-8
1(4(4(13benzodioxol5ylcarbonyl)piperazin1yl)phenyl)ethanone
1(4(4(13BENZODIOXOLE5CARBONYL)PIPERAZIN1YL)PHENYL)ETHANONE
1ACETYL4(4(2HBENZO(34D)13DIOXOLAN5YLCARBONYL)PIPERAZINYL)BENZENE
774589478
CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC20H20N2O4c114(23)152517(6315)2181022(11921)20(24)16471819(1216)26132518h2712H81113H21H3
MFCD06004413
ZINC000001054159
ZINC01054159
ZINC1054159

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Available files

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