Vitas-M small molecule compound

2,2,2-trifluoro-1-[4-(4-methoxyphenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]ethanone

Catalog ID
STK395094
SMILES COc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)C(F)(F)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 C21H22F3NO2 MW 377.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3NO2/c1-19(2)13-20(3,14-9-11-15(27-4)12-10-14)16-7-5-6-8-17(16)25(19)18(26)21(22,23)24/h5-12H,13H2,1-4H3
InChIKey
MWCXRAKGPSLVSR-UHFFFAOYSA-N
Synonyms

222TRIFLUORO1(4(4METHOXYPHENYL)224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)ETHANONE
222TRIFLUORO1(4(4METHOXYPHENYL)224TRIMETHYL3HQUINOLIN1YL)ETHANONE
CC1(CC(C2=CC=CC=C2N1C(=O)C(F)(F)F)(C)C3=CC=C(C=C3)OC)C
InChI=1SC21H22F3NO2c119(2)1320(31491115(274)121014)16756817(16)25(19)18(26)21(2223)24h512H13H214H3
MFCD00621886
ZINC000001228900
ZINC000001228901

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Available files

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