Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one
Catalog ID
STL512813
SMILES Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)C)C(=O)/C=C/c1ccc2c(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 C26H18BrNO3 MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18BrNO3/c1-16-25(22(29)11-7-17-8-12-23-24(13-17)31-15-30-23)26(18-5-3-2-4-6-18)20-14-19(27)9-10-21(20)28-16/h2-14H,15H2,1H3/b11-7+InChIKey
AYFWDOCIEMSDEK-YRNVUSSQSA-NSynonyms
331246-24-3(~(E))3(13benzodioxol5yl)1(6bromo2methyl4phenylquinolin3yl)prop2en1one
(2E)3(13benzodioxol5yl)1(6bromo2methyl4phenylquinolin3yl)prop2en1one
(E)3(13BENZODIOXOL5YL)1(6BROMO2METHYL4PHENYLQUINOLIN3YL)PROP2EN1ONE
(E)3(benzo(d)(13)dioxol5yl)1(6bromo2methyl4phenylquinolin3yl)prop2en1one
331246243
3BENZO(13)DIOXOL5YL1(6BROMO2METHYL4PHENYLQUINOLIN3YL)PROPENONE
5754154
Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)C)C(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC26H18BrNO3c11625(22(29)117178122324(1317)31153023)26(185324618)201419(27)91021(20)2816h214H15H21H3b117+
MFCD00613856
ZINC000012652856
ZINC12652856
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