Vitas-M small molecule compound
methyl 7-(1,3-benzodioxol-5-yl)-4-(2-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK375646
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)CC(C2)c1ccc2c(c1)OCO2
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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 C25H22FNO5 MW 435.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FNO5/c1-13-22(25(29)30-2)23(16-5-3-4-6-17(16)26)24-18(27-13)9-15(10-19(24)28)14-7-8-20-21(11-14)32-12-31-20/h3-8,11,15,23,27H,9-10,12H2,1-2H3InChIKey
SMUWBXOYAPXZFC-UHFFFAOYSA-NSynonyms
5787-14-45787144
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5F)C(=O)OC
InChI=1SC25H22FNO5c11322(25(29)302)23(16534617(16)26)2418(2713)915(1019(24)28)14782021(1114)32123120h3811152327H91012H212H3
methyl7(13benzodioxol5yl)4(2fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl7(13benzodioxol5yl)4(2fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD01191844
ZINC000019771452
ZINC000019771455
Check stock
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