Vitas-M small molecule compound

propyl 4-({7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4-oxo-4H-chromen-3-yl}oxy)benzoate

Catalog ID
STK921522
SMILES CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2CN1CCN(CC1)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 C26H30N2O6 MW 466.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O6/c1-4-15-32-26(31)18-5-7-19(8-6-18)34-24-17(2)33-25-20(23(24)30)9-10-22(29)21(25)16-28-13-11-27(3)12-14-28/h5-10,29H,4,11-16H2,1-3H3
InChIKey
UIBUWSHSNNMVSZ-UHFFFAOYSA-N
Synonyms
724741-05-3
2METHYL8((4METHYLPIPERAZIN1IUM1YL)METHYL)4OXO3(4PROPOXYCARBONYLPHENOXY)CHROMEN7OLATE
724741053
CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN4CCN(CC4)C)O)C
InChI=1SC26H30N2O6c14153226(31)185719(8618)342417(2)332520(23(24)30)91022(29)21(25)1628131127(3)121428h51029H41116H213H3
MFCD04167182
PROPYL4((7HYDROXY2METHYL8((4METHYL1PIPERAZINYL)METHYL)4OXO4HCHROMEN3YL)OXY)BENZOATE
propyl4((7hydroxy2methyl8((4methylpiperazin1yl)methyl)4oxo4Hchromen3yl)oxy)benzoate
PROPYL4(7HYDROXY2METHYL8((4METHYLPIPERAZIN1YL)METHYL)4OXOCHROMEN3YL)OXYBENZOATE
PROPYL4(7HYDROXY2METHYL8((4METHYLPIPERAZINYL)METHYL)4OXOCHROMEN3YLOXY)BENZOATE
ZINC000019924475
ZINC19924475

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Available files

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