Vitas-M small molecule compound
dimethyl 2-amino-4-(2-fluorophenyl)-5-oxo-1,7-diphenyl-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK775802
SMILES COC(=O)C1C(CC2=C(C1=O)C(C(=C(N2c1ccccc1)N)C(=O)OC)c1ccccc1F)c1ccccc1
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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 C31H27FN2O5 MW 526.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27FN2O5/c1-38-30(36)25-21(18-11-5-3-6-12-18)17-23-26(28(25)35)24(20-15-9-10-16-22(20)32)27(31(37)39-2)29(33)34(23)19-13-7-4-8-14-19/h3-16,21,24-25H,17,33H2,1-2H3InChIKey
WKRWKHPPMGDBCF-UHFFFAOYSA-NSynonyms
COC(=O)C1C(CC2=C(C1=O)C(C(=C(N2C3=CC=CC=C3)N)C(=O)OC)C4=CC=CC=C4F)C5=CC=CC=C5
dimethyl2amino4(2fluorophenyl)5oxo17diphenyl145678hexahydroquinoline36dicarboxylate
dimethyl2amino4(2fluorophenyl)5oxo17diphenyl4678tetrahydroquinoline36dicarboxylate
InChI=1SC31H27FN2O5c13830(36)2521(18115361218)172326(28(25)35)24(20159101622(20)32)27(31(37)392)29(33)34(23)19137481419h316212425H1733H212H3
MFCD05257819
ZINC000001422403
ZINC000036037290
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