Vitas-M small molecule compound

3-{3-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-3-oxopropyl}-7-methoxy-4-methyl-2H-chromen-2-one

Catalog ID
STK607414
SMILES COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)C(=O)C1COc2c(O1)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 C27H28N2O7 MW 492.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O7/c1-17-19-8-7-18(33-2)15-23(19)36-27(32)20(17)9-10-25(30)28-11-13-29(14-12-28)26(31)24-16-34-21-5-3-4-6-22(21)35-24/h3-8,15,24H,9-14,16H2,1-2H3
InChIKey
LDQIWADJVXEUAB-UHFFFAOYSA-N
Synonyms
903859-76-7
3(3(4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)3oxopropyl)7methoxy4methyl2Hchromen2one
3(3(4(23dihydro14benzodioxine3carbonyl)piperazin1yl)3oxopropyl)7methoxy4methylchromen2one
3(3(4(23dihydrobenzo(b)(14)dioxine2carbonyl)piperazin1yl)3oxopropyl)7methoxy4methyl2Hchromen2one
903859767
CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4
InChI=1SC27H28N2O7c117198718(332)1523(19)3627(32)20(17)91025(30)28111329(141228)26(31)24163421534622(21)3524h381524H91416H212H3
MFCD08290297
ZINC000009410496
ZINC000009410497

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Available files

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