Vitas-M small molecule compound
4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-3-(morpholin-4-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Catalog ID
STK403781
SMILES COc1cc(cc(c1O)Br)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)N1CCOCC1
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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 C22H25BrN2O5 MW 477.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN2O5/c1-12-18(22(28)25-6-8-30-9-7-25)19(20-15(24-12)4-3-5-16(20)26)13-10-14(23)21(27)17(11-13)29-2/h10-11,19,24,27H,3-9H2,1-2H3InChIKey
OOAHBNONLJRKMW-UHFFFAOYSA-NSynonyms
4(3bromo4hydroxy5methoxyphenyl)2methyl3(morpholin4ylcarbonyl)4678tetrahydroquinolin5(1H)one
4(3bromo4hydroxy5methoxyphenyl)2methyl3(morpholine4carbonyl)4678tetrahydro1Hquinolin5one
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)Br)O)OC)C(=O)N4CCOCC4
InChI=1SC22H25BrN2O5c11218(22(28)2568309725)19(2015(2412)43516(20)26)131014(23)21(27)17(1113)292h1011192427H39H212H3
MFCD03632515
ZINC000019901234
ZINC000019901236
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