Vitas-M small molecule compound
7-[(2-chloro-6-fluorobenzyl)oxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4H-chromen-4-one
Catalog ID
STK554822
SMILES CCc1cc2c(cc1OCc1c(F)cccc1Cl)oc(c(c2=O)c1ccc2c(c1)OCCCO2)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 C28H24ClFO5 MW 494.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClFO5/c1-3-17-12-19-25(14-24(17)34-15-20-21(29)6-4-7-22(20)30)35-16(2)27(28(19)31)18-8-9-23-26(13-18)33-11-5-10-32-23/h4,6-9,12-14H,3,5,10-11,15H2,1-2H3InChIKey
NCLQYXAXMHAXFM-UHFFFAOYSA-NSynonyms
610750-70-43(2H3H4HBENZO(B)14DIOXEPAN7YL)7((2CHLORO6FLUOROPHENYL)METHOXY)6ETHYL2METHYLCHROMEN4ONE
610750704
7((2chloro6fluorobenzyl)oxy)3(34dihydro2H15benzodioxepin7yl)6ethyl2methyl4Hchromen4one
7((2chloro6fluorobenzyl)oxy)3(34dihydro2Hbenzo(b)(14)dioxepin7yl)6ethyl2methyl4Hchromen4one
7((2CHLORO6FLUOROPHENYL)METHOXY)3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYL2METHYLCHROMEN4ONE
CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=CC=C5Cl)F
InChI=1SC28H24ClFO5c1317121925(1424(17)34152021(29)64722(20)30)3516(2)27(28(19)31)18892326(1318)33115103223h4691214H35101115H212H3
MFCD03966610
ZINC000002264037
ZINC02264037
ZINC2264037
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