Vitas-M small molecule compound

(6-fluoro-4-oxo-4H-chromen-3-yl)(pyrimidin-2-yl)methanediyl diacetate

Catalog ID
STK786555
SMILES CC(=O)OC(c1coc2c(c1=O)cc(cc2)F)(c1ncccn1)OC(=O)C

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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 C18H13FN2O6 MW 372.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13FN2O6/c1-10(22)26-18(27-11(2)23,17-20-6-3-7-21-17)14-9-25-15-5-4-12(19)8-13(15)16(14)24/h3-9H,1-2H3
InChIKey
JIOLIQXAIVTOQB-UHFFFAOYSA-N
Synonyms

(6fluoro4oxo4Hchromen3yl)(pyrimidin2yl)methanediyldiacetate
(acetyloxy(6fluoro4oxochromen3yl)pyrimidin2ylmethyl)acetate
CC(=O)OC(C1=COC2=C(C1=O)C=C(C=C2)F)(C3=NC=CC=N3)OC(=O)C
InChI=1SC18H13FN2O6c110(22)2618(2711(2)2317206372117)14925155412(19)813(15)16(14)24h39H12H3
MFCD09062788
ZINC000012364498
ZINC12364498

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.