Vitas-M small molecule compound

methyl 4-{4-[(2,4-dichlorobenzyl)oxy]phenyl}-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate

Catalog ID
STK035227
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccc(cc1Cl)Cl)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 C28H21Cl2NO4 MW 506.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21Cl2NO4/c1-15-23(28(33)34-2)24(25-26(31-15)20-5-3-4-6-21(20)27(25)32)16-8-11-19(12-9-16)35-14-17-7-10-18(29)13-22(17)30/h3-13,24,31H,14H2,1-2H3
InChIKey
QJVYDJLRJMJUDR-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)OCC5=C(C=C(C=C5)Cl)Cl)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccc(cc1Cl)Cl)C(=O)c1c2cccc1
InChI=1SC28H21Cl2NO4c11523(28(33)342)24(2526(3115)20534621(20)27(25)32)1681119(12916)35141771018(29)1322(17)30h3132431H14H212H3
METHYL4(4((24DICHLOROBENZYL)OXY)PHENYL)2METHYL5OXO45DIHYDRO1HINDENO(12B)PYRIDINE3CARBOXYLATE
METHYL4(4((24DICHLOROPHENYL)METHOXY)PHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
MFCD02218180
STK035227
ZINC000019804533
ZINC000019804535

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.