Vitas-M small molecule compound
7-hydroxy-2-methyl-3-(1-methyl-1H-benzimidazol-2-yl)-8-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]-4H-chromen-4-one
Catalog ID
STK887941
SMILES Oc1ccc2c(c1CN1CC3(CC1CC(C3)(C)C)C)oc(c(c2=O)c1nc2c(n1C)cccc2)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 C29H33N3O3 MW 471.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O3/c1-17-24(27-30-21-8-6-7-9-22(21)31(27)5)25(34)19-10-11-23(33)20(26(19)35-17)14-32-16-29(4)13-18(32)12-28(2,3)15-29/h6-11,18,33H,12-16H2,1-5H3InChIKey
AGJBXQJQARGBPL-UHFFFAOYSA-NSynonyms
7hydroxy2methyl3(1methyl1Hbenzimidazol2yl)8((133trimethyl6azabicyclo(321)oct6yl)methyl)4Hchromen4one
7HYDROXY2METHYL3(1METHYLBENZIMIDAZOL2YL)8((133TRIMETHYL6AZABICYCLO(321)OCT6YL)METHYL)CHROMEN4ONE
7HYDROXY2METHYL3(1METHYLBENZIMIDAZOL2YL)8((335TRIMETHYL7AZABICYCLO(321)OCTAN7YL)METHYL)CHROMEN4ONE
CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CC4(CC3CC(C4)(C)C)C)C5=NC6=CC=CC=C6N5C
InChI=1SC29H33N3O3c11724(273021867922(21)31(27)5)25(34)19101123(33)20(26(19)3517)14321629(4)1318(32)1228(23)1529h6111833H1216H215H3
MFCD03465194
ZINC000238881504
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