Vitas-M small molecule compound
3-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-fluoroquinazolin-4(3H)-one
Catalog ID
STL474207
SMILES COc1cc2CN(CCc2cc1OC)C(=O)Cn1cnc2c(c1=O)cc(cc2)F
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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 C21H20FN3O4 MW 397.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O4/c1-28-18-7-13-5-6-24(10-14(13)8-19(18)29-2)20(26)11-25-12-23-17-4-3-15(22)9-16(17)21(25)27/h3-4,7-9,12H,5-6,10-11H2,1-2H3InChIKey
KZLQESPOKSQJMG-UHFFFAOYSA-NSynonyms
1574496-31-31574496313
3(2(67dimethoxy34dihydro1Hisoquinolin2yl)2oxoethyl)6fluoroquinazolin4one
3(2(67dimethoxy34dihydroisoquinolin2(1H)yl)2oxoethyl)6fluoroquinazolin4(3H)one
COC1=C(C=C2CN(CCC2=C1)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F)OC
InChI=1SC21H20FN3O4c128187135624(1014(13)819(18)292)20(26)11251223174315(22)916(17)21(25)27h347912H561011H212H3
MFCD28051857
ZINC000045130783
ZINC45130783
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