Vitas-M small molecule compound
methyl N-{[3-(2-fluoro-4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}phenylalaninate
Catalog ID
STL154131
SMILES COC(=O)C(Cc1ccccc1)NC(=O)Cn1nc(ccc1=O)c1ccc(cc1F)OC
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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 C23H22FN3O5 MW 439.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O5/c1-31-16-8-9-17(18(24)13-16)19-10-11-22(29)27(26-19)14-21(28)25-20(23(30)32-2)12-15-6-4-3-5-7-15/h3-11,13,20H,12,14H2,1-2H3,(H,25,28)InChIKey
OVCSWYCEZMJJCY-UHFFFAOYSA-NSynonyms
(S)methyl2(2(3(2fluoro4methoxyphenyl)6oxopyridazin1(6H)yl)acetamido)3phenylpropanoate
COC(=O)(C@H)(Cc1ccccc1)NC(=O)Cn1nc(ccc1=O)c1ccc(cc1F)OC
COC1=CC(=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC(CC3=CC=CC=C3)C(=O)OC)F
InChI=1SC23H22FN3O5c131168917(18(24)1316)19101122(29)27(2619)1421(28)2520(23(30)322)12156435715h3111320H1214H212H3(H2528)
methyl2((2(3(2fluoro4methoxyphenyl)6oxopyridazin1yl)acetyl)amino)3phenylpropanoate
methylN((3(2fluoro4methoxyphenyl)6oxopyridazin1(6H)yl)acetyl)phenylalaninate
MFCD20756897
ZINC000071283035
ZINC000071328882
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