Vitas-M small molecule compound

1-[4-(1-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazole-3-carboxylic acid

Catalog ID
STL414477
SMILES Cn1ncc(c1)c1cc(nc(n1)n1ccc(n1)C(=O)O)C(F)(F)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 C13H9F3N6O2 MW 338.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9F3N6O2/c1-21-6-7(5-17-21)9-4-10(13(14,15)16)19-12(18-9)22-3-2-8(20-22)11(23)24/h2-6H,1H3,(H,23,24)
InChIKey
MRKWPEPDFHFYQF-UHFFFAOYSA-N
Synonyms
1006448-03-8
1(4(1methyl1Hpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)1Hpyrazole3carboxylicacid
1(4(1methylpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)pyrazole3carboxylicacid
1006448038
CN1C=C(C=N1)C2=CC(=NC(=N2)N3C=CC(=N3)C(=O)O)C(F)(F)F
InChI=1SC13H9F3N6O2c12167(51721)9410(13(1415)16)1912(189)22328(2022)11(23)24h26H1H3(H2324)
MFCD05861880
ZINC000002554333
ZINC2554333

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.