Vitas-M small molecule compound
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][2-(2-methylphenyl)quinolin-4-yl]methanone
Catalog ID
STK492855
SMILES O=C(c1cc(nc2c1cccc2)c1ccccc1C)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 C29H27N3O3 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O3/c1-20-6-2-3-7-22(20)26-17-24(23-8-4-5-9-25(23)30-26)29(33)32-14-12-31(13-15-32)18-21-10-11-27-28(16-21)35-19-34-27/h2-11,16-17H,12-15,18-19H2,1H3InChIKey
FQHSWQCJCYUVGW-UHFFFAOYSA-NSynonyms
(4(13benzodioxol5ylmethyl)piperazin1yl)(2(2methylphenyl)quinolin4yl)methanone
4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL2(2METHYLPHENYL)(4QUINOLYL)KETONE
CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6
InChI=1SC29H27N3O3c120623722(20)261724(23845925(23)3026)29(33)32141231(131532)182110112728(1621)35193427h2111617H12151819H21H3
MFCD03389292
ZINC000013893769
ZINC13893769
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