Vitas-M small molecule compound
[2-(2,3-dihydro-1,4-benzodioxin-6-yl)quinolin-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Catalog ID
STK444721
SMILES O=C(c1cc(nc2c1cccc2)c1ccc2c(c1)OCCO2)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 C29H24F3N3O3 MW 519.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24F3N3O3/c30-29(31,32)20-4-3-5-21(17-20)34-10-12-35(13-11-34)28(36)23-18-25(33-24-7-2-1-6-22(23)24)19-8-9-26-27(16-19)38-15-14-37-26/h1-9,16-18H,10-15H2InChIKey
VXMCZTPAHPABSC-UHFFFAOYSA-NSynonyms
(2(23dihydro14benzodioxin6yl)quinolin4yl)(4(3(trifluoromethyl)phenyl)piperazin1yl)methanone
2(2H3HBENZO(34E)14DIOXAN6YL)(4QUINOLYL)4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYLKETONE
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCCO6
InChI=1SC29H24F3N3O3c3029(3132)2043521(1720)34101235(131134)28(36)231825(3324721622(23)24)19892627(1619)3815143726h191618H1015H2
MFCD04057475
ZINC000020533850
ZINC20533850
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