Vitas-M small molecule compound

6-methyl 3-propyl 4-(2-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK404656
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)C(C(C2)C)C(=O)OC

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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 C23H26FNO5 MW 415.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26FNO5/c1-5-10-30-23(28)18-13(3)25-16-11-12(2)17(22(27)29-4)21(26)20(16)19(18)14-8-6-7-9-15(14)24/h6-9,12,17,19,25H,5,10-11H2,1-4H3
InChIKey
DNONYFKEVARLFG-UHFFFAOYSA-N
Synonyms

6methyl3propyl4(2fluorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3Opropyl4(2fluorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3F)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC23H26FNO5c15103023(28)1813(3)25161112(2)17(22(27)294)21(26)20(16)19(18)14867915(14)24h6912171925H51011H214H3
MFCD05238814
ZINC000020029065
ZINC000033936469

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Available files

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