Vitas-M small molecule compound
2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-6-(2-fluoro-4-methoxyphenyl)pyridazin-3(2H)-one
Catalog ID
STK930771
SMILES COc1ccc(c(c1)F)c1ccc(=O)n(n1)CC(=O)c1ccc2c(c1)OCCO2
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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 C21H17FN2O5 MW 396.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O5/c1-27-14-3-4-15(16(22)11-14)17-5-7-21(26)24(23-17)12-18(25)13-2-6-19-20(10-13)29-9-8-28-19/h2-7,10-11H,8-9,12H2,1H3InChIKey
LEMSDWLLBOSTNI-UHFFFAOYSA-NSynonyms
1224163-01-21224163012
2(2(23dihydro14benzodioxin6yl)2oxoethyl)6(2fluoro4methoxyphenyl)pyridazin3(2H)one
2(2(23dihydro14benzodioxin6yl)2oxoethyl)6(2fluoro4methoxyphenyl)pyridazin3one
2(2(23dihydrobenzo(b)(14)dioxin6yl)2oxoethyl)6(2fluoro4methoxyphenyl)pyridazin3(2H)one
COC1=CC(=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)C3=CC4=C(C=C3)OCCO4)F
InChI=1SC21H17FN2O5c127143415(16(22)1114)175721(26)24(2317)1218(25)13261920(1013)29982819h271011H8912H21H3
MFCD18069406
ZINC000044891403
ZINC44891403
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