Vitas-M small molecule compound

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

Catalog ID
STK888487
SMILES CCc1cc2c(cc1OCc1ccc(cc1Cl)Cl)occ(c2=O)c1ccc2c(c1)OCCO2

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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 C26H20Cl2O5 MW 483.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl2O5/c1-2-15-9-19-24(12-23(15)32-13-17-3-5-18(27)11-21(17)28)33-14-20(26(19)29)16-4-6-22-25(10-16)31-8-7-30-22/h3-6,9-12,14H,2,7-8,13H2,1H3
InChIKey
KIWAXHULVPCLDK-UHFFFAOYSA-N
Synonyms
610750-03-3
3(2H3HBENZO(34E)14DIOXAN6YL)7((24DICHLOROPHENYL)METHOXY)6ETHYLCHROMEN4ONE
610750033
7((24dichlorobenzyl)oxy)3(23dihydro14benzodioxin6yl)6ethyl4Hchromen4one
7((24dichlorobenzyl)oxy)3(23dihydrobenzo(b)(14)dioxin6yl)6ethyl4Hchromen4one
7((24DICHLOROPHENYL)METHOXY)3(23DIHYDRO14BENZODIOXIN6YL)6ETHYLCHROMEN4ONE
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OCC5=C(C=C(C=C5)Cl)Cl
InChI=1SC26H20Cl2O5c121591924(1223(15)3213173518(27)1121(17)28)331420(26(19)29)16462225(1016)31873022h3691214H27813H21H3
MFCD03660568
ZINC000001800997
ZINC01800997
ZINC1800997

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Available files

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