Vitas-M small molecule compound

7-[(4-bromobenzyl)oxy]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-2-methyl-4H-chromen-4-one

Catalog ID
STK626063
SMILES CCc1cc2c(cc1OCc1ccc(cc1)Br)oc(c(c2=O)c1ccc2c(c1)OCCO2)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 C27H23BrO5 MW 507.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrO5/c1-3-18-12-21-24(14-23(18)32-15-17-4-7-20(28)8-5-17)33-16(2)26(27(21)29)19-6-9-22-25(13-19)31-11-10-30-22/h4-9,12-14H,3,10-11,15H2,1-2H3
InChIKey
QVPZDQUAQUNUGN-UHFFFAOYSA-N
Synonyms
610750-99-7
3(2H3HBENZO(34E)14DIOXAN6YL)7((4BROMOPHENYL)METHOXY)6ETHYL2METHYLCHROMEN4ONE
610750997
7((4bromobenzyl)oxy)3(23dihydro14benzodioxin6yl)6ethyl2methyl4Hchromen4one
7((4bromobenzyl)oxy)3(23dihydrobenzo(b)(14)dioxin6yl)6ethyl2methyl4Hchromen4one
7((4BROMOPHENYL)METHOXY)3(23DIHYDRO14BENZODIOXIN6YL)6ETHYL2METHYLCHROMEN4ONE
CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCO4)OCC5=CC=C(C=C5)Br
InChI=1SC27H23BrO5c1318122124(1423(18)3215174720(28)8517)3316(2)26(27(21)29)19692225(1319)3111103022h491214H3101115H212H3
MFCD03660849
ZINC000001773813
ZINC01773813
ZINC1773813

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Available files

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