Vitas-M small molecule compound
1-[7-bromo-2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylic acid
Catalog ID
STL134891
SMILES COc1ccc(cc1)c1nc(N2CCC(CC2)C(=O)O)c2c(n1)Oc1c(C2)cc(cc1)Br
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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 C24H22BrN3O4 MW 496.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN3O4/c1-31-18-5-2-14(3-6-18)21-26-22(28-10-8-15(9-11-28)24(29)30)19-13-16-12-17(25)4-7-20(16)32-23(19)27-21/h2-7,12,15H,8-11,13H2,1H3,(H,29,30)InChIKey
MOLLWKHLKBESOC-UHFFFAOYSA-NSynonyms
1(7bromo2(4methoxyphenyl)5Hchromeno(23d)pyrimidin4yl)piperidine4carboxylicacid
COC1=CC=C(C=C1)C2=NC(=C3CC4=C(C=CC(=C4)Br)OC3=N2)N5CCC(CC5)C(=O)O
InChI=1SC24H22BrN3O4c131185214(3618)212622(2810815(91128)24(29)30)1913161217(25)4720(16)3223(19)2721h271215H81113H21H3(H2930)
MFCD20754140
ZINC000067341968
ZINC67341968
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