Vitas-M small molecule compound

2-{4-[2-hydroxy-3-(2-hydroxy-4,4-dimethyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)propoxy]phenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK642503
SMILES OC(CN1C(=NC(C1=O)(C)C)O)COc1ccc(cc1)N1C(=O)C2C(C1=O)CC=CC2

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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 C22H25N3O6 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O6/c1-22(2)20(29)24(21(30)23-22)11-14(26)12-31-15-9-7-13(8-10-15)25-18(27)16-5-3-4-6-17(16)19(25)28/h3-4,7-10,14,16-17,26H,5-6,11-12H2,1-2H3,(H,23,30)
InChIKey
HJIBHMRTIMQCCM-UHFFFAOYSA-N
Synonyms
344957-02-4
(3AR7AS)2(4(((2S)3(44DIMETHYL25DIOXOIMIDAZOLIDIN1YL)2HYDROXYPROPYL)OXY)PHENYL)3A477ATETRAHYDRO1HISOINDOLE13(2H)DIONE
2(4(2hydroxy3(2hydroxy44dimethyl5oxo45dihydro1Himidazol1yl)propoxy)phenyl)3a477atetrahydro1Hisoindole13(2H)dione
2(4(3(44DIMETHYL25DIOXOIMIDAZOLIDIN1YL)2HYDROXYPROPOXY)PHENYL)3A477ATETRAHYDROISOINDOLE13DIONE
3(3(4(13DIOXO(473A7ATETRAHYDROISOINDOL2YL))PHENOXY)2HYDROXYPROPYL)55DIMETHYL13DIAZOLIDINE24DIONE
344957024
CC1(C(=O)N(C(=O)N1)CC(COC2=CC=C(C=C2)N3C(=O)C4CC=CCC4C3=O)O)C
InChI=1SC22H25N3O6c122(2)20(29)24(21(30)2322)1114(26)1231159713(81015)2518(27)16534617(16)19(25)28h3471014161726H561112H212H3(H2330)
MFCD18162999
ZINC000004199463
ZINC000238899949

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.