Vitas-M small molecule compound

1-tert-butyl-4-{1-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one

Catalog ID
STK825033
SMILES COc1ccc(cc1)OCC(Cn1c(nc2c1cccc2)C1CC(=O)N(C1)C(C)(C)C)O

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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 C25H31N3O4 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O4/c1-25(2,3)28-14-17(13-23(28)30)24-26-21-7-5-6-8-22(21)27(24)15-18(29)16-32-20-11-9-19(31-4)10-12-20/h5-12,17-18,29H,13-16H2,1-4H3
InChIKey
JDNPASRPBICMKE-UHFFFAOYSA-N
Synonyms
1018053-58-1
1(TERTBUTYL)4(1(2HYDROXY3(4METHOXYPHENOXY)PROPYL)1HBENZO(D)IMIDAZOL2YL)PYRROLIDIN2ONE
1(TERTBUTYL)4(1(2HYDROXY3(4METHOXYPHENOXY)PROPYL)BENZIMIDAZOL2YL)PYRROLIDIN2ONE
1018053581
1tertbutyl4(1(2hydroxy3(4methoxyphenoxy)propyl)1Hbenzimidazol2yl)pyrrolidin2one
1tertbutyl4(1(2hydroxy3(4methoxyphenoxy)propyl)benzimidazol2yl)pyrrolidin2one
CC(C)(C)N1CC(CC1=O)C2=NC3=CC=CC=C3N2CC(COC4=CC=C(C=C4)OC)O
InChI=1SC25H31N3O4c125(23)281417(1323(28)30)242621756822(21)27(24)1518(29)16322011919(314)101220h512171829H1316H214H3
MFCD12548226
ZINC000016903068
ZINC000016903074

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Available files

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