Vitas-M small molecule compound
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][6-bromo-2-(2,5-dimethylphenyl)quinolin-4-yl]methanone
Catalog ID
STK452163
SMILES Brc1ccc2c(c1)c(cc(n2)c1cc(C)ccc1C)C(=O)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 C30H28BrN3O3 MW 558.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28BrN3O3/c1-19-3-4-20(2)23(13-19)27-16-25(24-15-22(31)6-7-26(24)32-27)30(35)34-11-9-33(10-12-34)17-21-5-8-28-29(14-21)37-18-36-28/h3-8,13-16H,9-12,17-18H2,1-2H3InChIKey
ABAOTQZSBNGHGE-UHFFFAOYSA-NSynonyms
(4(13benzodioxol5ylmethyl)piperazin1yl)(6bromo2(25dimethylphenyl)quinolin4yl)methanone
4((4(13BENZODIOXOL5YLMETHYL)1PIPERAZINYL)CARBONYL)6BROMO2(25DIMETHYLPHENYL)QUINOLINE
4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL2(25DIMETHYLPHENYL)6BROMO(4QUINOLYL)KETONE
CC1=CC(=C(C=C1)C)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6
InChI=1SC30H28BrN3O3c1193420(2)23(1319)271625(241522(31)6726(24)3227)30(35)3411933(101234)1721582829(1421)37183628h381316H9121718H212H3
MFCD03759385
ZINC000097948220
ZINC97948220
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