Vitas-M small molecule compound

(2E)-3-{3-[(2-fluorophenoxy)methyl]-4-methoxyphenyl}-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one

Catalog ID
STL337659
SMILES COc1ccc(cc1COc1ccccc1F)/C=C/C(=O)c1ccc2c(c1O)cccc2

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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 C27H21FO4 MW 428.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21FO4/c1-31-25-15-11-18(16-20(25)17-32-26-9-5-4-8-23(26)28)10-14-24(29)22-13-12-19-6-2-3-7-21(19)27(22)30/h2-16,30H,17H2,1H3/b14-10+
InChIKey
IHLSDFZTIWZIRW-GXDHUFHOSA-N
Synonyms
404918-39-4
(2E)3(3((2fluorophenoxy)methyl)4methoxyphenyl)1(1hydroxynaphthalen2yl)prop2en1one
(E)3(3((2FLUOROPHENOXY)METHYL)4METHOXYPHENYL)1(1HYDROXYNAPHTHALEN2YL)PROP2EN1ONE
404918394
COC1=C(C=C(C=C1)C=CC(=O)C2=C(C3=CC=CC=C3C=C2)O)COC4=CC=CC=C4F
COc1ccc(cc1COc1ccccc1F)C=CC(=O)c1ccc2c(c1O)cccc2
InChI=1SC27H21FO4c13125151118(1620(25)173226954823(26)28)101424(29)22131219623721(19)27(22)30h21630H17H21H3b1410+
MFCD03678446
ZINC000009427896
ZINC09427896
ZINC9427896

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Available files

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