Vitas-M small molecule compound
propyl 4-(2-fluorophenyl)-7-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK074916
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)CC(C2)c1ccccc1OC
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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 C27H28FNO4 MW 449.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28FNO4/c1-4-13-33-27(31)24-16(2)29-21-14-17(18-9-6-8-12-23(18)32-3)15-22(30)26(21)25(24)19-10-5-7-11-20(19)28/h5-12,17,25,29H,4,13-15H2,1-3H3InChIKey
MYDTUXQZYKGFBP-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)CC(C2)c1ccccc1OC
CCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3F)C(=O)CC(C2)C4=CC=CC=C4OC)C
InChI=1SC27H28FNO4c14133327(31)2416(2)29211417(189681223(18)323)1522(30)26(21)25(24)1910571120(19)28h512172529H41315H213H3
MFCD03371053
propyl4(2fluorophenyl)7(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl4(2fluorophenyl)7(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK074916
ZINC000002727243
ZINC000002727246
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