Vitas-M small molecule compound

2-(3,4-dimethylphenyl)-2-oxoethyl 6-bromo-2-(4-methylphenyl)quinoline-4-carboxylate

Catalog ID
STK269918
SMILES Cc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)OCC(=O)c1ccc(c(c1)C)C)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 C27H22BrNO3 MW 488.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrNO3/c1-16-4-7-19(8-5-16)25-14-23(22-13-21(28)10-11-24(22)29-25)27(31)32-15-26(30)20-9-6-17(2)18(3)12-20/h4-14H,15H2,1-3H3
InChIKey
SNPBKIOTPGYCET-UHFFFAOYSA-N
Synonyms
355421-81-7
(2(34DIMETHYLPHENYL)2OXOETHYL)6BROMO2(4METHYLPHENYL)QUINOLINE4CARBOXYLATE
2(34DIMETHYLPHENYL)2OXOETHYL6BROMO2(4METHYLPHENYL)4QUINOLINECARBOXYLATE
2(34dimethylphenyl)2oxoethyl6bromo2(4methylphenyl)quinoline4carboxylate
2(34DIMETHYLPHENYL)2OXOETHYL6BROMO2(PTOLYL)QUINOLINE4CARBOXYLATE
355421817
CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OCC(=O)C4=CC(=C(C=C4)C)C
InChI=1SC27H22BrNO3c1164719(8516)251423(221321(28)101124(22)2925)27(31)321526(30)209617(2)18(3)1220h414H15H213H3
MFCD02187890
ZINC000002079466
ZINC02079466
ZINC2079466

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Available files

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