Vitas-M small molecule compound

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

Catalog ID
STK048808
SMILES O=C(c1ccc2c(c1)OCO2)N1CCN(CC1)c1cccc(c1)C(F)(F)F

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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 C19H17F3N2O3 MW 378.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17F3N2O3/c20-19(21,22)14-2-1-3-15(11-14)23-6-8-24(9-7-23)18(25)13-4-5-16-17(10-13)27-12-26-16/h1-5,10-11H,6-9,12H2
InChIKey
CBDFSNSHNSVDOD-UHFFFAOYSA-N
Synonyms
303135-93-5
1(2H13BENZODIOXOL5YLCARBONYL)4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINE
13BENZODIOXOL5YL(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)METHANONE
2HBENZO(34D)13DIOXOLAN5YL4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYLKETONE
303135935
BENZO(13)DIOXOL5YL(4(3TRIFLUOROMETHYLPHENYL)PIPERAZIN1YL)METHANONE
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC19H17F3N2O3c2019(2122)1421315(1114)236824(9723)18(25)13451617(1013)27122616h151011H6912H2
MFCD01247559
O=C(c1ccc2c(c1)OCO2)N1CCN(CC1)c1cccc(c1)C(F)(F)F
STK048808
ZINC000000759259
ZINC00759259
ZINC759259

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Available files

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