Vitas-M small molecule compound
3-{2-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-2-oxoethyl}-4-methyl-2-oxo-2H-chromen-7-yl acetate
Catalog ID
STK604463
SMILES CC(=O)Oc1ccc2c(c1)oc(=O)c(c2C)CC(=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 C27H26N2O8 MW 506.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O8/c1-16-19-8-7-18(35-17(2)30)13-23(19)37-27(33)20(16)14-25(31)28-9-11-29(12-10-28)26(32)24-15-34-21-5-3-4-6-22(21)36-24/h3-8,13,24H,9-12,14-15H2,1-2H3InChIKey
CIJKUIGBELVVOD-UHFFFAOYSA-NSynonyms
920454-46-2(3(2(4(23dihydro14benzodioxine3carbonyl)piperazin1yl)2oxoethyl)4methyl2oxochromen7yl)acetate
3(2(4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)2oxoethyl)4methyl2oxo2Hchromen7ylacetate
3(2(4(23dihydrobenzo(b)(14)dioxine2carbonyl)piperazin1yl)2oxoethyl)4methyl2oxo2Hchromen7ylacetate
920454462
CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C)CC(=O)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4
InChI=1SC27H26N2O8c116198718(3517(2)30)1323(19)3727(33)20(16)1425(31)2891129(121028)26(32)24153421534622(21)3624h381324H9121415H212H3
MFCD08748727
ZINC000009341756
ZINC000009341759
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