Vitas-M small molecule compound

2-{[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]carbonyl}-5-methoxy-4H-pyran-4-one

Catalog ID
STL423102
SMILES COc1coc(cc1=O)C(=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 C20H20N2O7 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O7/c1-26-17-11-28-16(10-13(17)23)19(24)21-6-8-22(9-7-21)20(25)18-12-27-14-4-2-3-5-15(14)29-18/h2-5,10-11,18H,6-9,12H2,1H3
InChIKey
KQMSLJFGBPHNPT-UHFFFAOYSA-N
Synonyms
1676096-80-2
1676096802
2((4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)carbonyl)5methoxy4Hpyran4one
2(4(23dihydro14benzodioxine3carbonyl)piperazine1carbonyl)5methoxypyran4one
2(4(23dihydrobenzo(b)(14)dioxine2carbonyl)piperazine1carbonyl)5methoxy4Hpyran4one
COC1=COC(=CC1=O)C(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3
InChI=1SC20H20N2O7c12617112816(1013(17)23)19(24)216822(9721)20(25)18122714423515(14)2918h25101118H6912H21H3
MFCD28986669
ZINC000218496651
ZINC000218496725

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Available files

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