Vitas-M small molecule compound

2-(1,3-benzodioxol-5-yloxy)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethanone

Catalog ID
STK282914
SMILES O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)COc1ccc2c(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 C20H19F3N2O4 MW 408.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N2O4/c21-20(22,23)14-2-1-3-15(10-14)24-6-8-25(9-7-24)19(26)12-27-16-4-5-17-18(11-16)29-13-28-17/h1-5,10-11H,6-9,12-13H2
InChIKey
CKGHAIQUHOZXCU-UHFFFAOYSA-N
Synonyms
881781-15-3
2(13benzodioxol5yloxy)1(4(3(trifluoromethyl)phenyl)piperazin1yl)ethanone
2(2HBENZO(34D)13DIOXOLAN5YLOXY)1(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)ETHAN1ONE
881781153
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)COC3=CC4=C(C=C3)OCO4
InChI=1SC20H19F3N2O4c2120(2223)1421315(1014)246825(9724)19(26)122716451718(1116)29132817h151011H691213H2
MFCD07134297
ZINC000009096494
ZINC09096494
ZINC9096494

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Available files

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