Vitas-M small molecule compound

2,2'-({4-[2-(morpholin-4-yl)ethoxy]phenyl}methanediyl)bis[5-(4-methoxyphenyl)cyclohexane-1,3-dione]

Catalog ID
STK536174
SMILES COc1ccc(cc1)C1CC(=O)C(C(=O)C1)C(C1C(=O)CC(CC1=O)c1ccc(cc1)OC)c1ccc(cc1)OCCN1CCOCC1

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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 C39H43NO8 MW 653.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H43NO8/c1-45-30-9-3-25(4-10-30)28-21-33(41)38(34(42)22-28)37(27-7-13-32(14-8-27)48-20-17-40-15-18-47-19-16-40)39-35(43)23-29(24-36(39)44)26-5-11-31(46-2)12-6-26/h3-14,28-29,37-39H,15-24H2,1-2H3
InChIKey
CFKYGDMYOMHOBD-UHFFFAOYSA-N
Synonyms

22((4(2(morpholin4yl)ethoxy)phenyl)methanediyl)bis(5(4methoxyphenyl)cyclohexane13dione)
22((4(2morpholinoethoxy)phenyl)methylene)bis(5(4methoxyphenyl)cyclohexane13dione)
5(4METHOXYPHENYL)2((4(4METHOXYPHENYL)26DIOXOCYCLOHEXYL)(4(2MORPHOLIN4YLETHOXY)PHENYL)METHYL)CYCLOHEXANE13DIONE
COC1=CC=C(C=C1)C2CC(=O)C(C(=O)C2)C(C3C(=O)CC(CC3=O)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OCCN6CCOCC6
InChI=1SC39H43NO8c145309325(41030)282133(41)38(34(42)2228)37(2771332(14827)48201740151847191640)3935(43)2329(2436(39)44)2651131(462)12626h31428293739H1524H212H3
MFCD00698892
ZINC000150384205
ZINC150384205

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Available files

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