Vitas-M small molecule compound

2-methoxyethyl 2-amino-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate

Catalog ID
STK790776
SMILES COCCOC(=O)C1=C(N)OC2=C(C1c1ccc(cc1)F)C(=O)CC(C2)(C)C

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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 C21H24FNO5 MW 389.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24FNO5/c1-21(2)10-14(24)17-15(11-21)28-19(23)18(20(25)27-9-8-26-3)16(17)12-4-6-13(22)7-5-12/h4-7,16H,8-11,23H2,1-3H3
InChIKey
HCKNNRSHIKITPC-UHFFFAOYSA-N
Synonyms

2methoxyethyl2amino4(4fluorophenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
2METHOXYETHYL2AMINO4(4FLUOROPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
CC1(CC2=C(C(C(=C(O2)N)C(=O)OCCOC)C3=CC=C(C=C3)F)C(=O)C1)C
InChI=1SC21H24FNO5c121(2)1014(24)1715(1121)2819(23)18(20(25)2798263)16(17)124613(22)7512h4716H81123H213H3
MFCD00743845
ZINC000002462948
ZINC000002462950

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.