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Vitas-M small molecule compound

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

Catalog ID
STK921685
SMILES COC(=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 C24H26N2O6 MW 438.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O6/c1-15-22(32-17-6-4-16(5-7-17)24(29)30-3)21(28)18-8-9-20(27)19(23(18)31-15)14-26-12-10-25(2)11-13-26/h4-9,27H,10-14H2,1-3H3
InChIKey
MCJLNQAFMBCOOS-UHFFFAOYSA-N
Synonyms
844852-48-8
3(4METHOXYCARBONYLPHENOXY)2METHYL8((4METHYLPIPERAZIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
4((7HYDROXY2METHYL8((4METHYL1PIPERAZINYL)METHYL)4OXO1BENZOPYRAN3YL)OXY)BENZOICACIDMETHYLESTER
4(7HYDROXY4KETO2METHYL8((4METHYLPIPERAZINO)METHYL)CHROMEN3YL)OXYBENZOICACIDMETHYLESTER
844852488
CC1=C(C(=O)C2=C(O1)C(=C(C=C2)(O))C(NH+)3CCN(CC3)C)OC4=CC=C(C=C4)C(=O)OC
InChI=1SC24H26N2O6c11522(32176416(5717)24(29)303)21(28)188920(27)19(23(18)3115)1426121025(2)111326h4927H1014H213H3
methyl4((7hydroxy2methyl8((4methylpiperazin1yl)methyl)4oxo4Hchromen3yl)oxy)benzoate
METHYL4(2METHYL8((4METHYLPIPERAZIN1YL)METHYL)7OXIDANYL4OXIDANYLIDENECHROMEN3YL)OXYBENZOATE
METHYL4(7HYDROXY2METHYL8((4METHYLPIPERAZIN1YL)METHYL)4OXOCHROMEN3YL)OXYBENZOATE
METHYL4(7HYDROXY2METHYL8((4METHYLPIPERAZINYL)METHYL)4OXOCHROMEN3YLOXY)BENZOATE
MFCD04164478
ZINC000020358414
ZINC20358414

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Available files

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