Vitas-M small molecule compound

4-[3-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-1-(6-hydroxypyridazin-3-yl)-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol

Catalog ID
STK649941
SMILES CCOc1cc(ccc1OCC#C)C1CC(=Nc2c1c(C)nn2c1ccc(nn1)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 C22H21N5O4 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4/c1-4-10-31-16-7-6-14(11-17(16)30-5-2)15-12-20(29)23-22-21(15)13(3)26-27(22)18-8-9-19(28)25-24-18/h1,6-9,11,15H,5,10,12H2,2-3H3,(H,23,29)(H,25,28)
InChIKey
FJXGPEXBSCYULE-UHFFFAOYSA-N
Synonyms
1144458-53-6
1144458536
4(3ethoxy4(prop2yn1yloxy)phenyl)1(6hydroxypyridazin3yl)3methyl45dihydro1Hpyrazolo(34b)pyridin6ol
MFCD18165445
ZINC000031817483
ZINC000031817488

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Available files

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