Vitas-M small molecule compound
ethyl 4-[4-(dimethylamino)phenyl]-7-(4-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406072
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)c1ccc(cc1)F
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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 C27H29FN2O3 MW 448.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29FN2O3/c1-5-33-27(32)24-16(2)29-22-14-19(17-6-10-20(28)11-7-17)15-23(31)26(22)25(24)18-8-12-21(13-9-18)30(3)4/h6-13,19,25,29H,5,14-15H2,1-4H3InChIKey
KYMUSLFZNSAOOI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)N(C)C)C(=O)CC(C2)C4=CC=C(C=C4)F)C
ethyl4(4(dimethylamino)phenyl)7(4fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(4(dimethylamino)phenyl)7(4fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC27H29FN2O3c153327(32)2416(2)29221419(1761020(28)11717)1523(31)26(22)25(24)1881221(13918)30(3)4h613192529H51415H214H3
MFCD04216094
ZINC000002844993
ZINC000002844996
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Check stock on Vitas-MAvailable files
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