Vitas-M small molecule compound

9-(4-butoxy-3-methoxyphenyl)-3,3,6,6,10-pentamethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione

Catalog ID
STL507906
SMILES CCCCOc1ccc(cc1OC)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)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 C29H39NO4 MW 465.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H39NO4/c1-8-9-12-34-23-11-10-18(13-24(23)33-7)25-26-19(14-28(2,3)16-21(26)31)30(6)20-15-29(4,5)17-22(32)27(20)25/h10-11,13,25H,8-9,12,14-17H2,1-7H3
InChIKey
KCUMDHFXPSMUDX-UHFFFAOYSA-N
Synonyms

2231320
9(4butoxy3methoxyphenyl)336610pentamethyl3467910hexahydroacridine18(2H5H)dione
9(4butoxy3methoxyphenyl)336610pentamethyl4579tetrahydro2~(H)acridine18dione
InChI=1SC29H39NO4c189123423111018(1324(23)337)252619(1428(23)1621(26)31)30(6)201529(45)1722(32)27(20)25h10111325H89121417H217H3
MFCD06627311
ZINC000002879275
ZINC2879275

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Available files

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