Vitas-M small molecule compound

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

Catalog ID
STK888485
SMILES CCc1cc2c(cc1OCc1cccc(c1)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 C26H21ClO5 MW 448.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClO5/c1-2-17-11-20-24(13-23(17)31-14-16-4-3-5-19(27)10-16)32-15-21(26(20)28)18-6-7-22-25(12-18)30-9-8-29-22/h3-7,10-13,15H,2,8-9,14H2,1H3
InChIKey
SXHHCXKBUNYPGK-UHFFFAOYSA-N
Synonyms
610761-76-7
3(2H3HBENZO(34E)14DIOXAN6YL)7((3CHLOROPHENYL)METHOXY)6ETHYLCHROMEN4ONE
610761767
7((3chlorobenzyl)oxy)3(23dihydro14benzodioxin6yl)6ethyl4Hchromen4one
7((3chlorobenzyl)oxy)3(23dihydrobenzo(b)(14)dioxin6yl)6ethyl4Hchromen4one
7((3CHLOROPHENYL)METHOXY)3(23DIHYDRO14BENZODIOXIN6YL)6ETHYLCHROMEN4ONE
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OCC5=CC(=CC=C5)Cl
InChI=1SC26H21ClO5c1217112024(1323(17)31141643519(27)1016)321521(26(20)28)18672225(1218)30982922h37101315H28914H21H3
MFCD03660820
ZINC000002140691
ZINC02140691
ZINC2140691

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Available files

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