Vitas-M small molecule compound

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

Catalog ID
STL507913
SMILES CCCCOc1ccc(cc1C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)C)Cl

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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 C28H36ClNO3 MW 470.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36ClNO3/c1-7-8-11-33-23-10-9-17(29)12-18(23)24-25-19(13-27(2,3)15-21(25)31)30(6)20-14-28(4,5)16-22(32)26(20)24/h9-10,12,24H,7-8,11,13-16H2,1-6H3
InChIKey
WPMVATMBRTYWGC-UHFFFAOYSA-N
Synonyms

2229295
9(2butoxy5chlorophenyl)336610pentamethyl3467910hexahydroacridine18(2H5H)dione
9(2butoxy5chlorophenyl)336610pentamethyl4579tetrahydro2~(H)acridine18dione
InChI=1SC28H36ClNO3c17811332310917(29)1218(23)242519(1327(23)1521(25)31)30(6)201428(45)1622(32)26(20)24h9101224H78111316H216H3
MFCD06626592
ZINC000002876963
ZINC2876963

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Available files

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