Vitas-M small molecule compound
methyl 4-{5-bromo-2-[(4-fluorobenzyl)oxy]phenyl}-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate
Catalog ID
STL374236
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(Br)ccc1OCc1ccc(cc1)F)C(=O)c1c2cccc1
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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 C28H21BrFNO4 MW 534.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21BrFNO4/c1-15-23(28(33)34-2)24(25-26(31-15)19-5-3-4-6-20(19)27(25)32)21-13-17(29)9-12-22(21)35-14-16-7-10-18(30)11-8-16/h3-13,24,31H,14H2,1-2H3InChIKey
PBJDNQQNVOGWFH-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=C(C=CC(=C4)Br)OCC5=CC=C(C=C5)F)C(=O)OC
InChI=1SC28H21BrFNO4c11523(28(33)342)24(2526(3115)19534620(19)27(25)32)211317(29)91222(21)35141671018(30)11816h3132431H14H212H3
methyl4(5bromo2((4fluorobenzyl)oxy)phenyl)2methyl5oxo45dihydro1Hindeno(12b)pyridine3carboxylate
METHYL4(5BROMO2((4FLUOROPHENYL)METHOXY)PHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
MFCD02635525
ZINC000100215424
ZINC000100215429
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