Vitas-M small molecule compound
methyl 4-{4-[(4-fluorophenoxy)methyl]-3-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK960602
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)COc1ccc(cc1)F)C(=O)CCC2
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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 C26H26FNO5 MW 451.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26FNO5/c1-15-23(26(30)32-3)24(25-20(28-15)5-4-6-21(25)29)16-7-8-17(22(13-16)31-2)14-33-19-11-9-18(27)10-12-19/h7-13,24,28H,4-6,14H2,1-3H3InChIKey
IINKCHTXXXOIRL-UHFFFAOYSA-NSynonyms
445031-38-9445031389
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)COC4=CC=C(C=C4)F)OC)C(=O)OC
InChI=1SC26H26FNO5c11523(26(30)323)24(2520(2815)54621(25)29)167817(22(1316)312)14331911918(27)101219h7132428H4614H213H3
methyl4(4((4fluorophenoxy)methyl)3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4((4fluorophenoxy)methyl)3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02175470
ZINC000000648470
ZINC000002768118
Check stock
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Check stock on Vitas-MAvailable files
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