Vitas-M small molecule compound
4-[3-(2-fluoro-4-methoxyphenyl)-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STK636100
SMILES COc1ccc(c(c1)F)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)CCC(=O)O
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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 C22H19FN4O4 MW 422.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN4O4/c1-31-14-3-4-15(16(23)11-14)18-12-20(27(26-18)21(28)6-7-22(29)30)13-2-5-17-19(10-13)25-9-8-24-17/h2-5,8-11,20H,6-7,12H2,1H3,(H,29,30)InChIKey
JYDOYDAJSLJECG-UHFFFAOYSA-NSynonyms
1010877-47-01010877470
4(3(2fluoro4methoxyphenyl)5(quinoxalin6yl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(5(2fluoro4methoxyphenyl)3quinoxalin6yl34dihydropyrazol2yl)4oxobutanoicacid
COC1=CC(=C(C=C1)C2=NN(C(C2)C3=CC4=NC=CN=C4C=C3)C(=O)CCC(=O)O)F
InChI=1SC22H19FN4O4c131143415(16(23)1114)181220(27(2618)21(28)6722(29)30)13251719(1013)25982417h2581120H6712H21H3(H2930)
MFCD12199417
ZINC000012321708
ZINC000012321709
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