Vitas-M small molecule compound
2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxoethyl]-6-(2-fluorophenyl)pyridazin-3(2H)-one
Catalog ID
STK938549
SMILES O=C(c1ccc2c(c1)OCCCO2)Cn1nc(ccc1=O)c1ccccc1F
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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 C21H17FN2O4 MW 380.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O4/c22-16-5-2-1-4-15(16)17-7-9-21(26)24(23-17)13-18(25)14-6-8-19-20(12-14)28-11-3-10-27-19/h1-2,4-9,12H,3,10-11,13H2InChIKey
BWPMRQQHSUYLCV-UHFFFAOYSA-NSynonyms
1224165-51-81224165518
2(2(34dihydro2H15benzodioxepin7yl)2oxoethyl)6(2fluorophenyl)pyridazin3(2H)one
2(2(34dihydro2H15benzodioxepin7yl)2oxoethyl)6(2fluorophenyl)pyridazin3one
2(2(34dihydro2Hbenzo(b)(14)dioxepin7yl)2oxoethyl)6(2fluorophenyl)pyridazin3(2H)one
C1COC2=C(C=C(C=C2)C(=O)CN3C(=O)C=CC(=N3)C4=CC=CC=C4F)OC1
InChI=1SC21H17FN2O4c2216521415(16)177921(26)24(2317)1318(25)14681920(1214)28113102719h124912H3101113H2
MFCD18069015
ZINC000044903801
ZINC44903801
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