Vitas-M small molecule compound

3-(1H-benzimidazol-2-yl)-6-ethyl-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one

Catalog ID
STK888539
SMILES CCc1cc2c(c(c1O)CN1CCN(CC1)C)occ(c2=O)c1nc2c([nH]1)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 C24H26N4O3 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O3/c1-3-15-12-16-22(30)18(24-25-19-6-4-5-7-20(19)26-24)14-31-23(16)17(21(15)29)13-28-10-8-27(2)9-11-28/h4-7,12,14,29H,3,8-11,13H2,1-2H3,(H,25,26)
InChIKey
OHZHITNUDDGFOA-UHFFFAOYSA-N
Synonyms
637747-18-3
3(1Hbenzimidazol2yl)6ethyl7hydroxy8((4methylpiperazin1yl)methyl)4Hchromen4one
3(1HBENZIMIDAZOL2YL)6ETHYL7HYDROXY8((4METHYLPIPERAZIN1YL)METHYL)CHROMEN4ONE
3(1HBENZIMIDAZOL2YL)6ETHYL8((4METHYLPIPERAZIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
3(1Hbenzo(d)imidazol2yl)6ethyl7hydroxy8((4methylpiperazin1yl)methyl)4Hchromen4one
3BENZIMIDAZOL2YL6ETHYL7HYDROXY8((4METHYLPIPERAZINYL)METHYL)CHROMEN4ONE
637747183
CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4N3)C(NH+)5CCN(CC5)C)(O)
CCc1cc2c(c(c1O)CN1CCN(CC1)C)occ(c2=O)c1nc2c((nH)1)cccc2
InChI=1SC24H26N4O3c1315121622(30)18(242519645720(19)2624)143123(16)17(21(15)29)132810827(2)91128h47121429H381113H212H3(H2526)
MFCD03672285
ZINC000019682122
ZINC19682122

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Available files

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