Vitas-M small molecule compound

9-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione

Catalog ID
STK984357
SMILES COc1cc(ccc1OCc1ccccc1F)C1C2=C(NC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(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 C31H34FNO4 MW 503.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34FNO4/c1-30(2)13-21-28(23(34)15-30)27(29-22(33-21)14-31(3,4)16-24(29)35)18-10-11-25(26(12-18)36-5)37-17-19-8-6-7-9-20(19)32/h6-12,27,33H,13-17H2,1-5H3
InChIKey
XKJWSXVXRPBZOR-UHFFFAOYSA-N
Synonyms
684238-39-9
684238399
9(4((2fluorobenzyl)oxy)3methoxyphenyl)3366tetramethyl3467910hexahydroacridine18(2H5H)dione
9(4((2fluorophenyl)methoxy)3methoxyphenyl)3366tetramethyl2457910hexahydroacridine18dione
CC1(CC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OCC5=CC=CC=C5F)OC)C(=O)C1)C
InChI=1SC31H34FNO4c130(2)132128(23(34)1530)27(2922(3321)1431(34)1624(29)35)18101125(26(1218)365)371719867920(19)32h6122733H1317H215H3
ZINC20150229
ZINC39359632
ZINC9375384

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Available files

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