Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-8-[(dimethylamino)methyl]-7-hydroxy-6-propyl-2-(trifluoromethyl)-4H-chromen-4-one
Catalog ID
STL322915
SMILES CCCc1cc2c(=O)c(c3ccc4c(c3)OCO4)c(oc2c(c1O)CN(C)C)C(F)(F)F
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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 C23H22F3NO5 MW 449.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22F3NO5/c1-4-5-13-8-14-20(29)18(12-6-7-16-17(9-12)31-11-30-16)22(23(24,25)26)32-21(14)15(19(13)28)10-27(2)3/h6-9,28H,4-5,10-11H2,1-3H3InChIKey
CDILAJWKTPHBAE-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)8((dimethylamino)methyl)7hydroxy6propyl2(trifluoromethyl)4Hchromen4one
3(13benzodioxol5yl)8((dimethylamino)methyl)7hydroxy6propyl2(trifluoromethyl)chromen4one
3(13BENZODIOXOL5YL)8(DIMETHYLAMINOMETHYL)7HYDROXY6PROPYL2(TRIFLUOROMETHYL)CHROMEN4ONE
CCCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)CN(C)C)O
InChI=1SC23H22F3NO5c1451381420(29)18(12671617(912)31113016)22(23(2425)26)3221(14)15(19(13)28)1027(2)3h6928H451011H213H3
MFCD00525207
ZINC000001244139
ZINC1244139
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